Ethyl 4,6-diamino-2-[1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridin-3-yl]-5-pyrimidinyl(methyl)carbamate

Details

Stereochemistry	ACHIRAL
Molecular Formula	C21H21FN8O2
Molecular Weight	436.4422
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Ethyl 4,6-diamino-2-[1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridin-3-yl]-5-pyrimidinyl(methyl)carbamate

Structure Search

SMILES

CCOC(=O)N(C)C1=C(N)N=C(N=C1N)C2=NN(CC3=CC=CC=C3F)C4=C2C=CC=N4

InChI

InChIKey=KRAWHPFLLSOTJI-UHFFFAOYSA-N

InChI=1S/C21H21FN8O2/c1-3-32-21(31)29(2)16-17(23)26-19(27-18(16)24)15-13-8-6-10-25-20(13)30(28-15)11-12-7-4-5-9-14(12)22/h4-10H,3,11H2,1-2H3,(H4,23,24,26,27)

HIDE SMILES / InChI

Molecular Formula	C21H21FN8O2
Molecular Weight	436.4422
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 17:45:57 GMT 2025` Edited by `admin` on `Wed Apr 02 17:45:57 GMT 2025`
Record UNII	4C3L5UK7C6
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Ethyl 4,6-diamino-2-[1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridin-3-yl]-5-pyrimidinyl(methyl)carbamate

Systematic Name

English

Carbamic acid, [4,6-diamino-2-[1-[(2-fluorophenyl)methyl]-1H-pyrazolo[3,4-b]pyridin-3-yl]-5-pyrimidinyl]methyl-, ethyl ester

Preferred Name

English

Code System Code Type Description

CAS

625115-53-9

Created by admin on Wed Apr 02 17:45:57 GMT 2025 , Edited by admin on Wed Apr 02 17:45:57 GMT 2025

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PUBCHEM

21081986

Created by admin on Wed Apr 02 17:45:57 GMT 2025 , Edited by admin on Wed Apr 02 17:45:57 GMT 2025

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FDA UNII

4C3L5UK7C6

Created by admin on Wed Apr 02 17:45:57 GMT 2025 , Edited by admin on Wed Apr 02 17:45:57 GMT 2025

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