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3-[2-[2-cyclopentyl-6-(4-dimethoxyphosphorylanilino)purin-9-yl]ethyl]phenol | CAS No. 845895-51-4

3-[2-[2-cyclopentyl-6-(4-dimethoxyphosphorylanilino)purin-9-yl]ethyl]phenol

Basic Information

Chemical_Structure_Of

CAS Number

845895-51-4

Molecular Formula

C26H30N5O4P

Molecular Weight

475.53 g/mol

Basic Physical Properties

Density

1.35±0.1 g/cm3 (20 ºC 760 Torr)

SMILES

CP(=O)(C)C1=CC=C(C=C1)NC2=C3C(=NC(=N2)C4CCCC4)N(C=N3)CCC5=CC(=CC=C5)O

InChI

InChI=1S/C26H30N5O4P/c1-34-36(33,35-2)22-12-10-20(11-13-22)28-25-23-26(30-24(29-25)19-7-3-4-8-19)31(17-27-23)15-14-18-6-5-9-21(32)16-18/h5-6,9-13,16-17,19,32H,3-4,7-8,14-15H2,1-2H3,(H,28,29,30)

InChIKey

PADCFSVZOYFPCZ-UHFFFAOYSA-N

LogP

5.423800000000004

Topological Polar Surface Area

92.93 Å²

Hydrogen Bond Donor/Acceptor

2 / 7

Complexity

705

Synonyms & References

English

CHEMBL1089405
Phenol, 3-(2-(2-cyclopentyl-6-((4-(dimethylphosphinyl)phenyl)amino)-9H-purin-9-yl)ethyl)-
HEJ6QDU4PA
?3-[2-[2-cyclopentyl-6-(4-dimethylphosphorylanilino)purin-9-yl]ethyl]phenol
UNII-HEJ6QDU4PA
2,6,9-Trisubstitute purine, 6 (AP23464)
(4-((2-cyclopentyl-9-(3-hydroxyphenethyl)-9H-purin-6-yl)amino)phenyl)dimethylphosphine oxide
Phenol, 3-[2-[2-cyclopentyl-6-[[4-(dimethylphosphinyl)phenyl]amino]-9H-purin-9-yl]ethyl]-
AP23464
Q27461069
BCP22041
3-[2-[2-cyclopentyl-6-[[4-(dimethylphosphinyl)phenyl]amino]-9H-purin-9-yl]ethyl]Phenol
845895-51-4
AP23464; AP 23464
3-(2-(2-Cyclopentyl-6-((4-(dimethylphosphinyl)phenyl)amino)-9H-purin-9-yl)ethyl)phenol
BDBM50314074
3-[2-[2-cyclopentyl-6-(4-dimethylphosphorylanilino)purin-9-yl]ethyl]phenol
AP 23464 [WHO-DD]
3-(2-(2-cyclopentyl-6-(4-(dimethylphosphoryl)phenylamino)-9H-purin-9-yl)ethyl)phenol
SCHEMBL13576390
2bdj
AP-23464
C26H30N5O2P
3-[2-(2-CYCLOPENTYL-6-{[4-(DIMETHYLPHOSPHORYL)PHENYL]AMINO}-9H-PURIN-9-YL)ETHYL]PHENOL
AP-23464 [WHO-DD]
3-[2-[2-cyclopentyl-6-(4-dimethoxyphosphorylanilino)purin-9-yl]ethyl]phenol

MDL Number

MFCD18206808

Related Compounds

N-[(3S)-1-(Dimethylcarbamoyl)-3-pyrrolidinyl]-5-[(Z)-(5-fluoro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)methyl]-2,4-dimethyl-1H-pyrrole-3-carboxamide structure

N-[(3S)-1-(Dimethylcarbamoyl)-3-pyrrolidinyl]-5-[(Z)-(5-fluoro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)methyl]-2,4-dimethyl-1H-pyrrole-3-carboxamide

CAS Number: 1013920-15-4

Molecular Formula: C23H26FN5O3

7-Methylpyrazolo[1,5-a]pyrimidine-3-carboxylic acid structure

7-Methylpyrazolo[1,5-a]pyrimidine-3-carboxylic acid

CAS Number: 1016505-59-1

Molecular Formula: C8H7N3O2

(10,10,10-~2~H_3_)Decanoic acid structure

(10,10,10-~2~H_3_)Decanoic acid

CAS Number: 102611-15-4

Molecular Formula: C10H17D3O2

Methyl 8-methylquinoline-7-carboxylate structure

Methyl 8-methylquinoline-7-carboxylate

CAS Number: 1030846-94-6

Molecular Formula: C12H11NO2

2-Fluoro-6-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)benzoic acid structure

2-Fluoro-6-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)benzoic acid

CAS Number: 1048919-15-8

Molecular Formula: C12H14FNO4

4,6-Nonadecadiyn-1-ol structure

4,6-Nonadecadiyn-1-ol

CAS Number: 1071447-01-2

Molecular Formula: C19H32O

1,5,8-Trihydroxy-3-methoxy-2-(3-methyl-2-buten-1-yl)-9H-xanthen-9-one structure

1,5,8-Trihydroxy-3-methoxy-2-(3-methyl-2-buten-1-yl)-9H-xanthen-9-one

CAS Number: 110187-11-6

Molecular Formula: C19H18O6

Azithromycin EP Impurity J structure

Azithromycin EP Impurity J

CAS Number: 117693-41-1

Molecular Formula: C30H58N2O9

9-Benzyl-2,9-diazaspiro[5.5]undecane dihydrochloride structure

9-Benzyl-2,9-diazaspiro[5.5]undecane dihydrochloride

CAS Number: 1198286-24-6

Molecular Formula: C16H26Cl2N2

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Supplier Information

Shanghai TheftBiotechnology Co., Ltd.

CAS Number: 845895-51-4

Shanghai Anfen Chemical Technology Co., Ltd.

CAS Number: 845895-51-4

ShenZhenAiTaHuaXue Co Ltd

CAS Number: 845895-51-4