CK-0106023

Details

Stereochemistry	RACEMIC
Molecular Formula	C30H32BrClN4O2
Molecular Weight	595.958
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CCC(N(CCCN(C)C)C(=O)C1=CC=C(Br)C=C1)C2=NC3=C(C=CC(Cl)=C3)C(=O)N2CC4=CC=CC=C4

InChI

InChIKey=PZVLDHUUSWUATQ-UHFFFAOYSA-N

InChI=1S/C30H32BrClN4O2/c1-4-27(35(18-8-17-34(2)3)29(37)22-11-13-23(31)14-12-22)28-33-26-19-24(32)15-16-25(26)30(38)36(28)20-21-9-6-5-7-10-21/h5-7,9-16,19,27H,4,8,17-18,20H2,1-3H3

HIDE SMILES / InChI

Molecular Formula	C30H32BrClN4O2
Molecular Weight	595.958
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Approval Year

PubMed

Title	Date	PubMed
Discovery of (+)-N-(3-aminopropyl)-N-[1-(5-benzyl-3-methyl-4-oxo-[1,2]thiazolo[5,4-d]pyrimidin-6-yl)-2-methylpropyl]-4-methylbenzamide (AZD4877), a kinesin spindle protein inhibitor and potential anticancer agent.	2011 Oct 13	21899292

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:38:15 GMT 2023` Edited by `admin` on `Sat Dec 16 08:38:15 GMT 2023`
Record UNII	S38NRK3X01
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

CK-0106023

Common Name

English

BENZAMIDE, 4-BROMO-N-(1-(7-CHLORO-3,4-DIHYDRO-4-OXO-3-(PHENYLMETHYL)-2-QUINAZOLINYL)PROPYL)-N-(3-(DIMETHYLAMINO)PROPYL)-

Systematic Name

English

Code System Code Type Description

FDA UNII

S38NRK3X01

Created by admin on Sat Dec 16 08:38:15 GMT 2023 , Edited by admin on Sat Dec 16 08:38:15 GMT 2023

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PUBCHEM

11261882

Created by admin on Sat Dec 16 08:38:15 GMT 2023 , Edited by admin on Sat Dec 16 08:38:15 GMT 2023

PRIMARY

CAS

336115-72-1

Created by admin on Sat Dec 16 08:38:15 GMT 2023 , Edited by admin on Sat Dec 16 08:38:15 GMT 2023

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EPA CompTox

DTXSID40955247

Created by admin on Sat Dec 16 08:38:15 GMT 2023 , Edited by admin on Sat Dec 16 08:38:15 GMT 2023

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Related Record Type Details


					S38NRK3X01

CK-0106023

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