L-765314

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C27H34N6O5
Molecular Weight	522.5961
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

COC1=CC2=NC(=NC(N)=C2C=C1OC)N3CCN([C@@H](C3)C(=O)NC(C)(C)C)C(=O)OCC4=CC=CC=C4

InChI

InChIKey=CGWOIDCAGBKOQL-FQEVSTJZSA-N

InChI=1S/C27H34N6O5/c1-27(2,3)31-24(34)20-15-32(11-12-33(20)26(35)38-16-17-9-7-6-8-10-17)25-29-19-14-22(37-5)21(36-4)13-18(19)23(28)30-25/h6-10,13-14,20H,11-12,15-16H2,1-5H3,(H,31,34)(H2,28,29,30)/t20-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C27H34N6O5
Molecular Weight	522.5961
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 08:40:43 GMT 2025` Edited by `admin` on `Wed Apr 02 08:40:43 GMT 2025`
Record UNII	CR7JLF2GBM
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

L-765314

Code

English

A-322312

Preferred Name

English

Phenylmethyl (2S)-4-(4-amino-6,7-dimethoxy-2-quinazolinyl)-2-[[(1,1-dimethylethyl)amino]carbonyl]-1-piperazinecarboxylate

Systematic Name

English

1-Piperazinecarboxylic acid, 4-(4-amino-6,7-dimethoxy-2-quinazolinyl)-2-[[(1,1-dimethylethyl)amino]carbonyl]-, phenylmethyl ester, (2S)-

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID901028767