N-{1-[3-(2,5-Dimethylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]ethyl}-N-(2-methylpropyl)-3-phenylprop-2-enamide
Basic information
- CAS
5876-36-8- Standard SMILES
Cc1ccc(C)c(-n2c(C(C)N(CC(C)C)C(=O)C=Cc3ccccc3)nc3ccccc3c2=O)c1- InChIKey
ACEWZPXSYOLHSB-UHFFFAOYSA-N- Molecular formula
- C31H33N3O2
- Average molar mass
- 479.6 g/mol
- Monoisotopic mass
- 479.2572773
Names & identifiers
- Preferred name
- N-{1-[3-(2,5-Dimethylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]ethyl}-N-(2-methylpropyl)-3-phenylprop-2-enamide
- IUPAC
- N-[1-[3-(2,5-dimethylphenyl)-4-oxoquinazolin-2-yl]ethyl]-N-(2-methylpropyl)-3-phenylprop-2-enamide
Names & synonyms
5876-36-8DTXSID00410786N-{1-[3-(2,5-Dimethylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]ethyl}-N-(2-methylpropyl)-3-phenylprop-2-enamide
Database identifiers
- CAS
5876-36-8- PubChem CID
- 5217985
- DTXSID
DTXSID00410786
Properties
Computed structural properties
- XLogP
- 6.5
- Topological polar surface area
- 53 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 828
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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