5-CHLORO-N-(4-(4-CHLORO-2-THIENYL)-5-(4-CYCLOHEXYL-1-PIPERAZINYL)-2-THIAZOLYL)-6-(4-HYDROXY-1-PIPERIDINYL)-3-PYRIDINECARBOXAMIDE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C28H34Cl2N6O2S2
Molecular Weight	621.645
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 5-CHLORO-N-(4-(4-CHLORO-2-THIENYL)-5-(4-CYCLOHEXYL-1-PIPERAZINYL)-2-THIAZOLYL)-6-(4-HYDROXY-1-PIPERIDINYL)-3-PYRIDINECARBOXAMIDE

Structure Search

SMILES

OC1CCN(CC1)C2=NC=C(C=C2Cl)C(=O)NC3=NC(C4=CC(Cl)=CS4)=C(S3)N5CCN(CC5)C6CCCCC6

InChI

InChIKey=JLDDJJNSCVWAKW-UHFFFAOYSA-N

InChI=1S/C28H34Cl2N6O2S2/c29-19-15-23(39-17-19)24-27(36-12-10-34(11-13-36)20-4-2-1-3-5-20)40-28(32-24)33-26(38)18-14-22(30)25(31-16-18)35-8-6-21(37)7-9-35/h14-17,20-21,37H,1-13H2,(H,32,33,38)

HIDE SMILES / InChI

Molecular Formula	C28H34Cl2N6O2S2
Molecular Weight	621.645
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 `Sat Dec 16 15:07:47 UTC 2023` Edited by `admin` on `Sat Dec 16 15:07:47 UTC 2023`
Record UNII	27TCM4CPY3
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

5-CHLORO-N-(4-(4-CHLORO-2-THIENYL)-5-(4-CYCLOHEXYL-1-PIPERAZINYL)-2-THIAZOLYL)-6-(4-HYDROXY-1-PIPERIDINYL)-3-PYRIDINECARBOXAMIDE

Systematic Name

English

4-(DECARBOXY)-4-HYDROXY-AVATROMBOPAG

Common Name

English

3-PYRIDINECARBOXAMIDE, 5-CHLORO-N-(4-(4-CHLORO-2-THIENYL)-5-(4-CYCLOHEXYL-1-PIPERAZINYL)-2-THIAZOLYL)-6-(4-HYDROXY-1-PIPERIDINYL)-

Systematic Name

English

5-CHLORO-N-(4-(4-CHLORO-2-THIENYL)-5-(4-CYCLOHEXYLPIPERAZIN-1-YL)THIAZOL-2-YL)-6-(4-HYDROXY-1-PIPERIDYL)PYRIDINE-3-CARBOXAMIDE

Common Name

English

Code System Code Type Description

PUBCHEM

23030601

Created by admin on Sat Dec 16 15:07:47 UTC 2023 , Edited by admin on Sat Dec 16 15:07:47 UTC 2023

PRIMARY

FDA UNII

27TCM4CPY3

Created by admin on Sat Dec 16 15:07:47 UTC 2023 , Edited by admin on Sat Dec 16 15:07:47 UTC 2023

PRIMARY

CAS

778572-93-3

Created by admin on Sat Dec 16 15:07:47 UTC 2023 , Edited by admin on Sat Dec 16 15:07:47 UTC 2023

PRIMARY

Related Record Type Details


					3H8GSZ4SQL

AVATROMBOPAG

PARENT -> METABOLITE

Comments:

Avatrombopag's metabolites were detected in feces. There were no metabolites detected in plasma.

Interaction Type:

MAJOR

Amount: