C30H30N2O8 Uridine, 5′-O-[bis(4-methoxyphenyl)phenylmethyl]- (9CI, ACI)

imveliso

C30H30N2O8 Uridine, 5′-O-[bis(4-methoxyphenyl)phenylmethyl]- (9CI, ACI)

Ulwazi olusisiseko:


Iinkcukacha zeMveliso

Iithegi zeMveliso

Iimpawu ezibonakalayo

IiPropati zoMzimba eziPhambili Ixabiso Imeko
Ubunzima beMolekyuli 546.57 -
Indawo yokunyibilika (yoMfuniselo) 111-112 °C I-Solvent: I-Ethyl acetate
Ukuxinana (Kuqikelelwe) 1.343±0.06 g/cm3 Ubushushu: 20 °C;Cinezela: 760 Torr
pKa (Kuxelwe kwangaphambili) 9.39±0.10 Eyona Temp iAcidic Temp: 25 °C

Amanye Amagama kunye neZazi

Uncumo lweCanonical O=C1C=CN(C(=O)N1)C2OC(COC(C=3C=CC=CC3)(C4=CC=C(OC)C=C4)C5=CC=C(OC)C= C5)C(O)C2O
Isomeric Uncumo C(OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)N2C(=O)NC(=O)C=C2)(C3= CC=C(OC)C=C3)(C4=CC=C(OC)C=C4)C5=CC=CC=C5
InChi
InChI=1S/C30H30N2O8/c1-37-22-12-8-20(9-13-22)30(19-6-4-3-5-7-19,21-10-14-23(38- 2)15-11-21)39-18-24-26(34)27(35)28(40-24)32-
17-16-25(33)31-29(32)36/h3-17,24,26-28,34-35H,18H2,1-2H3,(H,31,33,36)/t24-,26 -,27-,28-/m1/s1
Isitshixo se-InchI
PCFSNQYXXACUHM-YULOIDQLSA-N
4 Amanye Amagama ale nto
5′-O-[Bis(4-methoxyphenyl)phenylmethyl]uridine (ACI);Uridine, 5′-O-[α,α-bis (p-methoxyphenyl) benzyl]- (7CI);5′-Dimethoxytrityl uridine;5′-O-(4,4′-Dimethoxytrityl)uridine

Iipropati zoMfuniselo

Iipropati ezikhoyo
Thermal

Thermal

Ipropati Ixabiso Imeko

Umthombo

Indawo yokunyibilika 122-123 °C    

(1) I-CAS

Indawo yokunyibilika 111-112 °C Isinyibilikisi: I-Ethyl acetate

(2) CAS

Indawo yokunyibilika Jonga iSibhalo esipheleleyo    

(3) CAS

(1) uZekri, uNegar;I-Bulletin ye-Chemical Society yase-Ethiopia, (2010), i-24 (2), i-299-304, i-CAPPlus

(2) uPatil, uPremanand Ramrao;Ijenali yeCarbohydrate Chemistry, (2008), 27(5), 279-293, CAplus

(3) uKhalafi-Nezhad, uAli;Iileta zeTetrahedron, (2004), 45(36), 6737-6739, CAplus

ISpectra yoMfuniselo

ISpectra ekhoyo
1H NMR
13C NMR
IMisa

Iipropati eziqikelelweyo

Iipropati ezikhoyo
Ibhayoloji
Ikhemikhali
Ukuxinana
Lipinski
Ulwakhiwo oluNxulumeneyo

Ibhayoloji

Ipropati Ixabiso Imeko Umthombo
I-Bioconcentration Factor 904 pH 1;Ubushushu: 25 °C (1) ACD
I-Bioconcentration Factor 904 pH 2;Ubushushu: 25 °C (1) ACD
I-Bioconcentration Factor 904 pH 3;Ubushushu: 25 °C (1) ACD
I-Bioconcentration Factor 904 pH 4;Ubushushu: 25 °C (1) ACD
I-Bioconcentration Factor 904 pH 5;Ubushushu: 25 °C (1) ACD
I-Bioconcentration Factor 904 pH 6;Ubushushu: 25 °C (1) ACD
I-Bioconcentration Factor 900 pH 7;Ubushushu: 25 °C (1) ACD
I-Bioconcentration Factor 861 pH 8;Ubushushu: 25 °C (1) ACD
I-Bioconcentration Factor 602 pH 9;Ubushushu: 25 °C (1) ACD

 

Ipropati Ixabiso Imeko Umthombo
I-Bioconcentration Factor 156 pH 10;Ubushushu: 25 °C (1) ACD

(1) Kubalwa kusetyenziswa uPhuhliso lweKhemistry oluPhezulu (ACD/Labs) iSoftware V11.02 (© 1994-2023 ACD/Labs)

Ikhemikhali

Ipropati Ixabiso Imeko Umthombo
Koc 4550 pH 1;Ubushushu: 25 °C (1) ACD
Koc 4550 pH 2;Ubushushu: 25 °C (1) ACD
Koc 4550 pH 3;Ubushushu: 25 °C (1) ACD
Koc 4550 pH 4;Ubushushu: 25 °C (1) ACD
Koc 4550 pH 5;Ubushushu: 25 °C (1) ACD
Koc 4540 pH 6;Ubushushu: 25 °C (1) ACD
Koc 4520 pH 7;Ubushushu: 25 °C (1) ACD
Koc 4330 pH 8;Ubushushu: 25 °C (1) ACD
Koc 3030 pH 9;Ubushushu: 25 °C (1) ACD
Koc 785 pH 10;Ubushushu: 25 °C (1) ACD
logD 4.19 pH 1;Ubushushu: 25 °C (1) ACD
logD 4.19 pH 2;Ubushushu: 25 °C (1) ACD
logD 4.19 pH 3;Ubushushu: 25 °C (1) ACD
logD 4.19 pH 4;Ubushushu: 25 °C (1) ACD
logD 4.19 pH 5;Ubushushu: 25 °C (1) ACD
logD 4.19 pH 6;Ubushushu: 25 °C (1) ACD
logD 4.19 pH 7;Ubushushu: 25 °C (1) ACD
logD 4.17 pH 8;Ubushushu: 25 °C (1) ACD
logD 4.02 pH 9;Ubushushu: 25 °C (1) ACD
logD 3.43 pH 10;Ubushushu: 25 °C (1) ACD
logP 4.192±0.628 Ubushushu: 25 °C (1) ACD
Ukunyibilika kweMass Intrinsic 3.2 x 10-4 g/L Ubushushu: 25 °C (1) ACD
Ukunyibilika kobuninzi 3.2 x 10-4 g/L pH 1;Ubushushu: 25 °C (1) ACD
Ukunyibilika kobuninzi 3.2 x 10-4 g/L pH 2;Ubushushu: 25 °C (1) ACD
Ukunyibilika kobuninzi 3.2 x 10-4 g/L pH 3;Ubushushu: 25 °C (1) ACD
Ukunyibilika kobuninzi 3.2 x 10-4 g/L pH 4;Ubushushu: 25 °C (1) ACD
Ukunyibilika kobuninzi 3.2 x 10-4 g/L pH 5;Ubushushu: 25 °C (1) ACD
Ukunyibilika kobuninzi 3.2 x 10-4 g/L pH 6;Ubushushu: 25 °C (1) ACD
Ukunyibilika kobuninzi 3.2 x 10-4 g/L pH 7;Ubushushu: 25 °C (1) ACD

 

Ipropati Ixabiso Imeko Umthombo
Ukunyibilika kobuninzi 3.3 x 10-4 g/L pH 8;Ubushushu: 25 °C (1) ACD
Ukunyibilika kobuninzi 4.8 x 10-4 g/L pH 9;Ubushushu: 25 °C (1) ACD
Ukunyibilika kobuninzi 1.9 x 10-3 g/L pH 10;Ubushushu: 25 °C (1) ACD
Ukunyibilika kobuninzi 3.2 x 10-4 g/L Amanzi angaphazanyiswanga pH 6.99;Ubushushu: 25 °C (1) ACD
I-Molar Intrinsic Solubility 5.8 x 10-7 mol/L Ubushushu: 25 °C (1) ACD
Ukunyibilika kweMolar 5.8 x 10-7 mol/L pH 1;Ubushushu: 25 °C (1) ACD
Ukunyibilika kweMolar 5.8 x 10-7 mol/L pH 2;Ubushushu: 25 °C (1) ACD
Ukunyibilika kweMolar 5.8 x 10-7 mol/L pH 3;Ubushushu: 25 °C (1) ACD
Ukunyibilika kweMolar 5.8 x 10-7 mol/L pH 4;Ubushushu: 25 °C (1) ACD
Ukunyibilika kweMolar 5.8 x 10-7 mol/L pH 5;Ubushushu: 25 °C (1) ACD
Ukunyibilika kweMolar 5.8 x 10-7 mol/L pH 6;Ubushushu: 25 °C (1) ACD
Ukunyibilika kweMolar 5.8 x 10-7 mol/L pH 7;Ubushushu: 25 °C (1) ACD
Ukunyibilika kweMolar 6.1 x 10-7 mol/L pH 8;Ubushushu: 25 °C (1) ACD
Ukunyibilika kweMolar 8.7 x 10-7 mol/L pH 9;Ubushushu: 25 °C (1) ACD
Ukunyibilika kweMolar 3.4 x 10-6 mol / L pH 10;Ubushushu: 25 °C (1) ACD
Ukunyibilika kweMolar 5.8 x 10-7 mol/L Amanzi angaphazanyiswanga pH 6.99;Ubushushu: 25 °C (1) ACD
Ubunzima beMolekyuli 546.57    
pKa 9.39±0.10 Eyona Temp iAcidic Temp: 25 °C (1) ACD

(1) Kubalwa kusetyenziswa uPhuhliso lweKhemistry oluPhezulu (ACD/Labs) iSoftware V11.02 (© 1994-2023 ACD/Labs)

Ukuxinana

Ipropati Ixabiso Imeko Umthombo
Ukuxinana 1.343±0.06 g/cm3 Ubushushu: 20 °C;Cinezela: 760 Torr (1) ACD
Umthamo weMolar 406.9±3.0 cm3/mol Ubushushu: 20 °C;Cinezela: 760 Torr (1) ACD

(1) Kubalwa kusetyenziswa uPhuhliso lweKhemistry oluPhezulu (ACD/Labs) iSoftware V11.02 (© 1994-2023 ACD/Labs)

Lipinski

Ipropati Ixabiso Imeko Umthombo
Iibhondi eziGuquguqukayo ngokukhululekileyo 11   (1) ACD
H Abamkeli 10   (1) ACD
H Abaxhasi 3   (1) ACD
H Umnikeli/uMamkeli Isambuku 13   (1) ACD
logP 4.192±0.628 Ubushushu: 25 °C (1) ACD
 

 

Ipropati Ixabiso

Imeko

Umthombo
Ubunzima beMolekyuli 546.57

(1) Kubalwa kusetyenziswa uPhuhliso lweKhemistry oluPhezulu (ACD/Labs) iSoftware V11.02 (© 1994-2023 ACD/Labs)

Ulwakhiwo oluNxulumeneyo

Ipropati Ixabiso

Imeko

Umthombo
Indawo yePolar Surface 127 A2 (1) ACD

(1) Kubalwa kusetyenziswa uPhuhliso lweKhemistry oluPhezulu (ACD/Labs) iSoftware V11.02 (© 1994-2023 ACD/Labs)

ISpectra eqikelelweyo

ISpectra ekhoyo
1H NMR
13C NMR


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