N-(2-methyl-4-oxoquinazolin-3-yl)benzamide
Basic information
- CAS
6761-14-4- Standard SMILES
Cc1nc2ccccc2c(=O)n1NC(=O)c1ccccc1- InChIKey
JQCDMRJKMBYDBB-UHFFFAOYSA-N- Molecular formula
- C16H13N3O2
- Average molar mass
- 279.29 g/mol
- Monoisotopic mass
- 279.10077667
Names & identifiers
- Preferred name
- N-(2-methyl-4-oxoquinazolin-3-yl)benzamide
- IUPAC
- N-(2-methyl-4-oxoquinazolin-3-yl)benzamide
Names & synonyms
N-(2-methyl-4-oxoquinazolin-3-yl)benzamide6761-14-4N-(2-Methyl-4-oxo-4H-quinazolin-3-yl)-benzamideN-(2-Methyl-4-oxoquinazolin-3(4H)-yl)benzamideBAS 01023341Oprea1_089479Oprea1_613629MLS001212628CHEMBL1163744DTXSID301321458HMS1680K22HMS2841I07
Show more names
AKOS000533334SMR000515837ST50244131SR-01000316813SR-01000316813-1BRD-K42398020-001-07-4N-(2-methyl-4-oxo(3-hydroquinazolin-3-yl))benzamide
Database identifiers
- CAS
6761-14-4- PubChem CID
- 807598
- DTXSID
DTXSID301321458- ChEMBL
CHEMBL1163744
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 61.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 454
Experimental & physicochemical properties
Solubility40.8 [ug/mL] (The mean of the results at pH 7.4)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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