C30H29FN2O7 Uridine, 5'-O-[bis(4-methoxyphenyl) phenylmethyl]-2'-deoxy-2'- fluoro- (9CI, ACI)

alaabta

C30H29FN2O7 Uridine, 5'-O-[bis(4-methoxyphenyl) phenylmethyl]-2'-deoxy-2'- fluoro- (9CI, ACI)

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Faahfaahinta Alaabta

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Tilmaamaha jirka

Qalabka Jidhka ee Furaha ah Qiimaha Xaalad
Miisaanka Molecular 548.56 -
Meesha dhalaalaysa (Tijaabo) 118-120 °C -
Cufnaanta (La saadaaliyay) 1.38± 0.1 g/cm3 Heerkulka: 20 °C;Riix: 760 Torr
pKa (La saadaaliyay) 9.39±0.10 Heerkulka ugu acidic badan: 25 °C

Magacyo Kale iyo Aqoonsiyo

Dhoola caddaynta 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)C2F
Isomeric SMILES C(OC[C@H]1O[C@H]([C@H](F)[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/C30H29FN2O7/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)39-18-24-27(35)26(31)28(40-24)33
-17-16-25(34)32-29(33)36/h3-17,24,26-28,35H,18H2,1-2H3,(H,32,34,36)/t24-,26- ,27-,28-/m1/s1
Furaha InChi
CSSFZSSZXOCCJB-YULOIDQLSA-N
1 Magaca kale ee walaxdan
5'-O-[Bis (4-methoxyphenyl) phenylmethyl]-2'-deoxy-2'-fluorouridine (ACI)

Guryaha Tijaabada

Guryaha la heli karo
kulaylka

kulaylka

Hanti Qiimaha Xaalad Xigasho
Meesha dhalaalaysa 118-120 °C (1) CAS

(1) Penjarla, Srishylam;Nucleosides, Nucleotides & Nucleic Acids, (2018), 37(4), 232-247, CAplus

Tijaabada Spectra

Spectra waa la heli karaa
1H NMR
13C NMR

Guryaha la saadaaliyay

Guryaha la heli karo
Nafley
Kiimiko
Cufnaanta
Lipinski
Qaab-dhismeedka La Xiriira

Nafley

Hanti Qiimaha Xaalad Xigasho
Qodobka bioconcentration 3580 pH 1;Heerkulka: 25 °C (1) ACD
Qodobka bioconcentration 3580 pH 2;Heerkulka: 25 °C (1) ACD
Qodobka bioconcentration 3580 pH 3;Heerkulka: 25 °C (1) ACD
Qodobka bioconcentration 3580 pH 4;Heerkulka: 25 °C (1) ACD
Qodobka bioconcentration 3580 pH 5;Heerkulka: 25 °C (1) ACD
Qodobka bioconcentration 3580 pH 6;Heerkulka: 25 °C (1) ACD
Qodobka bioconcentration 3570 pH 7;Heerkulka: 25 °C (1) ACD
Qodobka bioconcentration 3430 pH 8;Heerkulka: 25 °C (1) ACD
Qodobka bioconcentration 2500 pH 9;Heerkulka: 25 °C (1) ACD
Qodobka bioconcentration 689 pH 10;Heerkulka: 25 °C (1) ACD

(1) Waxaa la xisaabiyay iyadoo la isticmaalayo Horumarinta Kiimikada Sare (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Kiimiko

Hanti Qiimaha Xaalad Xigasho
Koc 12200 pH 1;Heerkulka: 25 °C (1) ACD
Koc 12200 pH 2;Heerkulka: 25 °C (1) ACD
Koc 12200 pH 3;Heerkulka: 25 °C (1) ACD
Koc 12200 pH 4;Heerkulka: 25 °C (1) ACD
Koc 12200 pH 5;Heerkulka: 25 °C (1) ACD
Koc 12200 pH 6;Heerkulka: 25 °C (1) ACD
Koc 12100 pH 7;Heerkulka: 25 °C (1) ACD
Koc 11700 pH 8;Heerkulka: 25 °C (1) ACD
Koc 8480 pH 9;Heerkulka: 25 °C (1) ACD
Koc 2340 pH 10;Heerkulka: 25 °C (1) ACD
logD 4.98 pH 1;Heerkulka: 25 °C (1) ACD
logD 4.98 pH 2;Heerkulka: 25 °C (1) ACD
logD 4.98 pH 3;Heerkulka: 25 °C (1) ACD
logD 4.98 pH 4;Heerkulka: 25 °C (1) ACD
logD 4.98 pH 5;Heerkulka: 25 °C (1) ACD
logD 4.98 pH 6;Heerkulka: 25 °C (1) ACD
logD 4.98 pH 7;Heerkulka: 25 °C (1) ACD
logD 4.96 pH 8;Heerkulka: 25 °C (1) ACD
logD 4.82 pH 9;Heerkulka: 25 °C (1) ACD
logD 4.26 pH 10;Heerkulka: 25 °C (1) ACD
logP 4.979±0.563 Heerkulka: 25 °C (1) ACD
Solubility Mass Intrinsic 9.9 x 10-5 g/L Heerkulka: 25 °C (1) ACD
Xalka tirada badan 9.9 x 10-5 g/L pH 1;Heerkulka: 25 °C (1) ACD
Xalka tirada badan 9.9 x 10-5 g/L pH 2;Heerkulka: 25 °C (1) ACD
Xalka tirada badan 9.9 x 10-5 g/L pH 3;Heerkulka: 25 °C (1) ACD
Xalka tirada badan 9.9 x 10-5 g/L pH 4;Heerkulka: 25 °C (1) ACD
Xalka tirada badan 9.9 x 10-5 g/L pH 5;Heerkulka: 25 °C (1) ACD
Xalka tirada badan 9.9 x 10-5 g/L pH 6;Heerkulka: 25 °C (1) ACD
Xalka tirada badan 9.9 x 10-5 g/L pH 7;Heerkulka: 25 °C (1) ACD
Xalka tirada badan 9.9 x 10-5 g/L pH 8;Heerkulka: 25 °C (1) ACD
Xalka tirada badan 1.4 x 10-4 g/L pH 9;Heerkulka: 25 °C (1) ACD
Xalka tirada badan 5.0 x 10-4 g/L pH 10;Heerkulka: 25 °C (1) ACD

 

Hanti Qiimaha Xaalad Xigasho
Xalka tirada badan 9.9 x 10-5 g/L Biyaha aan la daboolin pH 7.00;Heerkulka: 25 °C (1) ACD
Solubility Intrinsic Molar 1.8 x 10-7 mol/L Heerkulka: 25 °C (1) ACD
Solubility Molar 1.8 x 10-7 mol/L pH 1;Heerkulka: 25 °C (1) ACD
Solubility Molar 1.8 x 10-7 mol/L pH 2;Heerkulka: 25 °C (1) ACD
Solubility Molar 1.8 x 10-7 mol/L pH 3;Heerkulka: 25 °C (1) ACD
Solubility Molar 1.8 x 10-7 mol/L pH 4;Heerkulka: 25 °C (1) ACD
Solubility Molar 1.8 x 10-7 mol/L pH 5;Heerkulka: 25 °C (1) ACD
Solubility Molar 1.8 x 10-7 mol/L pH 6;Heerkulka: 25 °C (1) ACD
Solubility Molar 1.8 x 10-7 mol/L pH 7;Heerkulka: 25 °C (1) ACD
Solubility Molar 1.8 x 10-7 mol/L pH 8;Heerkulka: 25 °C (1) ACD
Solubility Molar 2.5 x 10-7 mol/L pH 9;Heerkulka: 25 °C (1) ACD
Solubility Molar 9.2 x 10-7 mol/L pH 10;Heerkulka: 25 °C (1) ACD
Solubility Molar 1.8 x 10-7 mol/L Biyaha aan la daboolin pH 7.00;Heerkulka: 25 °C (1) ACD
Miisaanka Molecular 548.56    
pKa 9.39±0.10 Heerkulka ugu acidic badan: 25 °C (1) ACD

(1) Waxaa la xisaabiyay iyadoo la isticmaalayo Horumarinta Kiimikada Sare (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Cufnaanta

Hanti Qiimaha Xaalad Xigasho
Cufnaanta 1.38± 0.1 g/cm3 Heerkulka: 20 °C;Riix: 760 Torr (1) ACD
Mugga Molar 395.8± 5.0 cm3 / mol Heerkulka: 20 °C;Riix: 760 Torr (1) ACD

(1) Waxaa la xisaabiyay iyadoo la isticmaalayo Horumarinta Kiimikada Sare (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Lipinski

Hanti Qiimaha Xaalad Xigasho
Boondhigyo si xor ah loo wareejin karo 10   (1) ACD
H Aqbalayaasha 9   (1) ACD
H Deeq-bixiyayaasha 2   (1) ACD
Ku-deeqaha/Aqbalka Wadarta 11   (1) ACD
logP 4.979±0.563 Heerkulka: 25 °C (1) ACD
Miisaanka Molecular 548.56    

(1) Waxaa la xisaabiyay iyadoo la isticmaalayo Horumarinta Kiimikada Sare (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Qaab-dhismeedka La Xiriira

Hanti Qiimaha

Xaalad

Xigasho
Aagga dusha sare ee Polar 107 A2 (1) ACD

(1) Waxaa la xisaabiyay iyadoo la isticmaalayo Horumarinta Kiimikada Sare (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Spectra la saadaaliyay

Spectra waa la heli karaa
1H NMR
13C NMR


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