Palbociclib N-Oxide

Details

Stereochemistry	ACHIRAL
Molecular Formula	C24H29N7O3
Molecular Weight	463.5322
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC(=O)C1=C(C)C2=C(N=C(NC3=NC=C(C=C3)[N+]4([O-])CCNCC4)N=C2)N(C5CCCC5)C1=O

InChI

InChIKey=ZDIMBNTYWUUTJC-UHFFFAOYSA-N

InChI=1S/C24H29N7O3/c1-15-19-14-27-24(28-20-8-7-18(13-26-20)31(34)11-9-25-10-12-31)29-22(19)30(17-5-3-4-6-17)23(33)21(15)16(2)32/h7-8,13-14,17,25H,3-6,9-12H2,1-2H3,(H,26,27,28,29)

HIDE SMILES / InChI

Molecular Formula	C24H29N7O3
Molecular Weight	463.5322
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 18:53:00 GMT 2023` Edited by `admin` on `Sat Dec 16 18:53:00 GMT 2023`
Record UNII	CQ6Y33H744
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Palbociclib N-Oxide

Common Name

English

1-(6-((6-acetyl-8-cyclopentyl-5-methyl-7-oxo-7,8-dihydropyrido[2,3-d]pyrimidin-2-yl)amino)pyridin-3-yl)piperazine 1-oxide

Systematic Name

English

Pyrido[2,3-d]pyrimidin-7(8H)-one, 6-acetyl-8-cyclopentyl-5-methyl-2-[[5-(1-oxido-1-piperazinyl)-2-pyridinyl]amino]-

Systematic Name

English

6-Acetyl-8-cyclopentyl-5-methyl-2-[[5-(1-oxido-1-piperazinyl)-2-pyridinyl]amino]pyrido[2,3-d]pyrimidin-7(8H)-one

Systematic Name

English

1-[6-({6-acetyl-8-cyclopentyl-5-methyl-7-oxo-7H,8H-pyrido[2,3-d]pyrimidin-2-yl}amino)pyridin-3-yl]piperazin-1-ium-1-olate

Common Name

English

Code System Code Type Description

CAS

2174002-29-8

Created by admin on Sat Dec 16 18:53:00 GMT 2023 , Edited by admin on Sat Dec 16 18:53:00 GMT 2023

PRIMARY

PUBCHEM

152630072

Created by admin on Sat Dec 16 18:53:00 GMT 2023 , Edited by admin on Sat Dec 16 18:53:00 GMT 2023

PRIMARY

FDA UNII

CQ6Y33H744

Created by admin on Sat Dec 16 18:53:00 GMT 2023 , Edited by admin on Sat Dec 16 18:53:00 GMT 2023

PRIMARY

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PALBOCICLIB

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