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

oloa

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

Fa'amatalaga Autu:


Fa'amatalaga Oloa

Faailoga o oloa

Meatotino faaletino

Meatotino Faaletino Autu Taua Tulaga
Molecular Weight 548.56 -
Lisi Lisi (Fa'ata'ita'i) 118-120 °C -
To'atele (Va'ai) 1.38±0.1g/cm3 Maalili: 20 °C; Lomitusi: 760 Torr
pKa (vala'aina) 9.39±0.10 Le Tele o le Acid Temp: 25 °C

Isi Igoa ma Fa'ailoaga

O'O'ITA'I 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
InChI Ki
CSSFZSSZXOCCJB-YULOIDQLSA-N
1 Isi igoa mo lenei mea
5′-O-[Bis(4-methoxyphenyl)phenylmethyl]-2′-deoxy-2′-fluorouridine (ACI)

Meatotino Fa'ata'ita'i

Meatotino avanoa
Mafanafana

Mafanafana

Meatotino Taua Tulaga Punavai
Lisi Lisi 118-120 °C (1) CAS

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

Fa'ata'ita'iga Spectra

Spectra avanoa
1H NMR
13C NMR

Meatotino Va'ai

Meatotino avanoa
Fa'aolaola
Kemisi
Malosi
Lipinski
Fauga Faatatau

Fa'aolaola

Meatotino Taua Tulaga Punavai
Bioconcentration Factor 3580 pH 1; Maalili: 25 °C (1) ACD
Bioconcentration Factor 3580 pH 2; Maalili: 25 °C (1) ACD
Bioconcentration Factor 3580 pH 3; Maalili: 25 °C (1) ACD
Bioconcentration Factor 3580 pH 4; Maalili: 25 °C (1) ACD
Bioconcentration Factor 3580 pH 5; Maalili: 25 °C (1) ACD
Bioconcentration Factor 3580 pH 6; Maalili: 25 °C (1) ACD
Bioconcentration Factor 3570 pH 7; Maalili: 25 °C (1) ACD
Bioconcentration Factor 3430 pH 8; Maalili: 25 °C (1) ACD
Bioconcentration Factor 2500 pH 9; Maalili: 25 °C (1) ACD
Bioconcentration Factor 689 pH 10; Maalili: 25 °C (1) ACD

(1) Fa'atatau i le fa'aaogaina o le Atina'eina o Kemisi Maualuga (ACD/Labs) Polokalama V11.02 (© 1994-2023 ACD/Labs)

Kemisi

Meatotino Taua Tulaga Punavai
Koc 12200 pH 1; Maalili: 25 °C (1) ACD
Koc 12200 pH 2; Maalili: 25 °C (1) ACD
Koc 12200 pH 3; Maalili: 25 °C (1) ACD
Koc 12200 pH 4; Maalili: 25 °C (1) ACD
Koc 12200 pH 5; Maalili: 25 °C (1) ACD
Koc 12200 pH 6; Maalili: 25 °C (1) ACD
Koc 12100 pH 7; Maalili: 25 °C (1) ACD
Koc 11700 pH 8; Maalili: 25 °C (1) ACD
Koc 8480 pH 9; Maalili: 25 °C (1) ACD
Koc 2340 pH 10; Maalili: 25 °C (1) ACD
ogalaauD 4.98 pH 1; Maalili: 25 °C (1) ACD
ogalaauD 4.98 pH 2; Maalili: 25 °C (1) ACD
ogalaauD 4.98 pH 3; Maalili: 25 °C (1) ACD
ogalaauD 4.98 pH 4; Maalili: 25 °C (1) ACD
ogalaauD 4.98 pH 5; Maalili: 25 °C (1) ACD
ogalaauD 4.98 pH 6; Maalili: 25 °C (1) ACD
ogalaauD 4.98 pH 7; Maalili: 25 °C (1) ACD
ogalaauD 4.96 pH 8; Maalili: 25 °C (1) ACD
ogalaauD 4.82 pH 9; Maalili: 25 °C (1) ACD
ogalaauD 4.26 pH 10; Maalili: 25 °C (1) ACD
logP 4.979±0.563 Maalili: 25 °C (1) ACD
Mass Intrinsic Solubility 9.9 x 10-5 g/L Maalili: 25 °C (1) ACD
Mass Solubility 9.9 x 10-5 g/L pH 1; Maalili: 25 °C (1) ACD
Mass Solubility 9.9 x 10-5 g/L pH 2; Maalili: 25 °C (1) ACD
Mass Solubility 9.9 x 10-5 g/L pH 3; Maalili: 25 °C (1) ACD
Mass Solubility 9.9 x 10-5 g/L pH 4; Maalili: 25 °C (1) ACD
Mass Solubility 9.9 x 10-5 g/L pH 5; Maalili: 25 °C (1) ACD
Mass Solubility 9.9 x 10-5 g/L pH 6; Maalili: 25 °C (1) ACD
Mass Solubility 9.9 x 10-5 g/L pH 7; Maalili: 25 °C (1) ACD
Mass Solubility 9.9 x 10-5 g/L pH 8; Maalili: 25 °C (1) ACD
Mass Solubility 1.4 x 10-4 g/L pH 9; Maalili: 25 °C (1) ACD
Mass Solubility 5.0 x 10-4 g/L pH 10; Maalili: 25 °C (1) ACD

 

Meatotino Taua Tulaga Punavai
Mass Solubility 9.9 x 10-5 g/L Suavai e le fa'afefe pH 7.00; Maalili: 25 °C (1) ACD
Molar Intrinsic Solubility 1.8 x 10-7 mol/L Maalili: 25 °C (1) ACD
Molar Solubility 1.8 x 10-7 mol/L pH 1; Maalili: 25 °C (1) ACD
Molar Solubility 1.8 x 10-7 mol/L pH 2; Maalili: 25 °C (1) ACD
Molar Solubility 1.8 x 10-7 mol/L pH 3; Maalili: 25 °C (1) ACD
Molar Solubility 1.8 x 10-7 mol/L pH 4; Maalili: 25 °C (1) ACD
Molar Solubility 1.8 x 10-7 mol/L pH 5; Maalili: 25 °C (1) ACD
Molar Solubility 1.8 x 10-7 mol/L pH 6; Maalili: 25 °C (1) ACD
Molar Solubility 1.8 x 10-7 mol/L pH 7; Maalili: 25 °C (1) ACD
Molar Solubility 1.8 x 10-7 mol/L pH 8; Maalili: 25 °C (1) ACD
Molar Solubility 2.5 x 10-7 mol/L pH 9; Maalili: 25 °C (1) ACD
Molar Solubility 9.2 x 10-7 mol/L pH 10; Maalili: 25 °C (1) ACD
Molar Solubility 1.8 x 10-7 mol/L Suavai e le fa'afefe pH 7.00; Maalili: 25 °C (1) ACD
Molecular Weight 548.56    
pKa 9.39±0.10 Le Tele o le Acid Temp: 25 °C (1) ACD

(1) Fa'atatau i le fa'aaogaina o le Atina'eina o Kemisi Maualuga (ACD/Labs) Polokalama V11.02 (© 1994-2023 ACD/Labs)

Malosi

Meatotino Taua Tulaga Punavai
Malosi 1.38±0.1g/cm3 Maalili: 20 °C; Lomitusi: 760 Torr (1) ACD
Molar Volume 395.8±5.0 cm3/mol Maalili: 20 °C; Lomitusi: 760 Torr (1) ACD

(1) Fa'atatau i le fa'aaogaina o le Atina'eina o Kemisi Maualuga (ACD/Labs) Polokalama V11.02 (© 1994-2023 ACD/Labs)

Lipinski

Meatotino Taua Tulaga Punavai
Noanoaga e mafai ona fesuia'i saoloto 10   (1) ACD
H Tagata talia 9   (1) ACD
H Donors 2   (1) ACD
H Fa'ameaalofa/Tagata Talia 11   (1) ACD
logP 4.979±0.563 Maalili: 25 °C (1) ACD
Molecular Weight 548.56    

(1) Fa'atatau i le fa'aaogaina o le Atina'eina o Kemisi Maualuga (ACD/Labs) Polokalama V11.02 (© 1994-2023 ACD/Labs)

Fauga Faatatau

Meatotino Taua

Tulaga

Punavai
Polar Surface Area 107 A2 (1) ACD

(1) Fa'atatau i le fa'aaogaina o le Atina'eina o Kemisi Maualuga (ACD/Labs) Polokalama V11.02 (© 1994-2023 ACD/Labs)

Va'aiga Spectra

Spectra avanoa
1H NMR
13C NMR


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