AC1L8ABN structure

AC1L8ABN

2-[[4-[(2,4-diaminoquinazolin-6-yl)methyl-formylamino]benzoyl]amino]pentanedioic acid

Also Known As: 2-[[4-[(2,4-diaminoquinazolin-6-yl)methyl-formylamino]benzoyl]amino]pentanedioic acid|2-{4-[(2,4-Diamino-quinazolin-6-ylmethyl)-formyl-amino]-benzoylamino}-pentanedioic acid|N-(4-{N-[(2,4-Diaminoquinazolin-6-yl)methyl]formamido}benzoyl)glutamic acid

CAS: 61075-41-0
Molecular Formula C22H22N6O6
Molecular Weight 466.1601 g/mol
LogP 0.5
Topological Polar Surface Area 202.0 Ų
Hydrogen Bond Donors 5
Hydrogen Bond Acceptors 10
Rotatable Bonds 9
Exact Mass 466.1601
Monoisotopic Mass 466.1601
Heavy Atoms 34
Complexity 745.0

Chemical Identifiers

CAS Number 61075-41-0
SMILES C1=CC(=CC=C1C(=O)NC(CCC(=O)O)C(=O)O)N(CC2=CC3=C(C=C2)N=C(N=C3N)N)C=O
InChIKey WFKZHYAJLQEESN-UHFFFAOYSA-N

Product Overview

AC1L8ABN (CAS 61075-41-0), with molecular formula C22H22N6O6 and molecular weight 466.1601 g/mol. IUPAC: 2-[[4-[(2,4-diaminoquinazolin-6-yl)methyl-formylamino]benzoyl]amino]pentanedioic acid.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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