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

Details

Stereochemistry	ACHIRAL
Molecular Formula	C22H23FN8O2
Molecular Weight	450.4688
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

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

Structure Search

SMILES

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

InChI

InChIKey=VBVQTIZAMNWWJI-UHFFFAOYSA-N

InChI=1S/C22H23FN8O2/c1-12(2)33-22(32)30(3)17-18(24)27-20(28-19(17)25)16-14-8-6-10-26-21(14)31(29-16)11-13-7-4-5-9-15(13)23/h4-10,12H,11H2,1-3H3,(H4,24,25,27,28)

HIDE SMILES / InChI

Molecular Formula	C22H23FN8O2
Molecular Weight	450.4688
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 17:18:56 GMT 2025` Edited by `admin` on `Wed Apr 02 17:18:56 GMT 2025`
Record UNII	U32TNF6XZW
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Riociguat Impurity D

Preferred Name

English

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

Systematic Name

English

Riociguat impurity 11

Common Name

English

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

Systematic Name

English

Code System Code Type Description

FDA UNII

U32TNF6XZW

Created by admin on Wed Apr 02 17:18:56 GMT 2025 , Edited by admin on Wed Apr 02 17:18:56 GMT 2025

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PUBCHEM

17973414

Created by admin on Wed Apr 02 17:18:56 GMT 2025 , Edited by admin on Wed Apr 02 17:18:56 GMT 2025

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CAS

625115-54-0

Created by admin on Wed Apr 02 17:18:56 GMT 2025 , Edited by admin on Wed Apr 02 17:18:56 GMT 2025

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