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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 63708Generated: November 3, 2026

2-Methyl-3-(4-nitrophenyl)quinazolin-4-one

https://huagongshe.com/en/chemical/63708

2-Methyl-3-(4-nitrophenyl)quinazolin-4-one molecular structure

Identifiers & Physical Properties

CAS No.1788-96-1
Molecular formulaC15H11N3O3
Average molar mass281.27 g/mol
Monoisotopic mass281.08004122 g/mol
SMILESCc1nc2ccccc2c(=O)n1-c1ccc([N+](=O)[O-])cc1
InChIKeyYOHKWEFKBJNRBR-UHFFFAOYSA-N
PubChem CID63708
ChEMBLCHEMBL580891
DTXSIDDTXSID90275684

Chemical & Physical Properties

XLogP2
Topological polar surface area78.5
Hydrogen bond donors0
Hydrogen bond acceptors4
Rotatable bonds1
Heavy atoms21
Formal charge0
Complexity463
Solubility>42.2 [ug/mL] (The mean of the results at pH 7.4)