AC1MI4UO structure

AC1MI4UO

1-[[2-(6-bromo-2-methyl-4-oxoquinazolin-3-yl)acetyl]amino]-3-(3-methylphenyl)thiourea

Also Known As: 3(4H)-Quinazolineacetic acid, 6-bromo-2-methyl-4-oxo-, 2-(((3-methylphenyl)amino)thioxomethyl)hydrazide|1-[[2-(6-bromo-2-methyl-4-oxoquinazolin-3-yl)acetyl]amino]-3-(3-methylphenyl)thiourea|2-[(6-Bromo-2-methyl-4-oxoquinazolin-3(4H)-yl)acetyl]-N-(3-methylphenyl)hydrazine-1-carbothioamide

CAS: 40889-57-4
Molecular Formula C19H18BrN5O2S
Molecular Weight 459.03647 g/mol
LogP 2.79364
Topological Polar Surface Area 88.05 Ų
Hydrogen Bond Donors 3
Hydrogen Bond Acceptors 4
Rotatable Bonds 3
Exact Mass 459.03647
Monoisotopic Mass 459.03647
Heavy Atoms 28
Complexity 1128.9973

Chemical Identifiers

CAS Number 40889-57-4
SMILES CC1=CC(=CC=C1)NC(=S)NNC(=O)CN2C(=NC3=C(C2=O)C=C(C=C3)Br)C

Product Overview

AC1MI4UO (CAS 40889-57-4), with molecular formula C19H18BrN5O2S and molecular weight 459.03647 g/mol. IUPAC: 1-[[2-(6-bromo-2-methyl-4-oxoquinazolin-3-yl)acetyl]amino]-3-(3-methylphenyl)thiourea.

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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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