2-(4-chlorophenyl)-N-(6,6-dimethyl-8-oxo-5,7-dihydroquinazolin-2-yl)acetamide
Basic information
- CAS
5812-89-5- Standard SMILES
CC1(C)CC(=O)c2nc(NC(=O)Cc3ccc(Cl)cc3)ncc2C1- InChIKey
HKJRPTDIXGUTDR-UHFFFAOYSA-N- Molecular formula
- C18H18ClN3O2
- Average molar mass
- 343.8 g/mol
- Monoisotopic mass
- 343.1087545
Names & identifiers
- Preferred name
- 2-(4-chlorophenyl)-N-(6,6-dimethyl-8-oxo-5,7-dihydroquinazolin-2-yl)acetamide
- IUPAC
- 2-(4-chlorophenyl)-N-(6,6-dimethyl-8-oxo-5,7-dihydroquinazolin-2-yl)acetamide
Names & synonyms
5812-89-52-(4-chlorophenyl)-N-(6,6-dimethyl-8-oxo-5,7-dihydroquinazolin-2-yl)acetamide2-(4-chlorophenyl)-N-(6,6-dimethyl-8-oxo-5,6,7,8-tetrahydro-2-quinazolinyl)acetamideCBMicro_034491Oprea1_232911SCHEMBL883074DTXSID50362120BIM-0034296.P001SR-01000221143SR-01000221143-12-(4-Chlorophenyl)-N-(6,6-dimethyl-8-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)acetamide
Database identifiers
- CAS
5812-89-5- PubChem CID
- 1361732
- DTXSID
DTXSID50362120
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 72 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 489
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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