3-benzyl-N-cyclopentyl-2-{[(4-ethenylphenyl)methyl]sulfanyl}-4-oxo-3,4-dihydroquinazoline-7-carboxamide
Chemical Structure Depiction of
3-benzyl-N-cyclopentyl-2-{[(4-ethenylphenyl)methyl]sulfanyl}-4-oxo-3,4-dihydroquinazoline-7-carboxamide
3-benzyl-N-cyclopentyl-2-{[(4-ethenylphenyl)methyl]sulfanyl}-4-oxo-3,4-dihydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | G836-0070 |
| Compound Name: | 3-benzyl-N-cyclopentyl-2-{[(4-ethenylphenyl)methyl]sulfanyl}-4-oxo-3,4-dihydroquinazoline-7-carboxamide |
| Molecular Weight: | 495.64 |
| Molecular Formula: | C30 H29 N3 O2 S |
| Smiles: | C=Cc1ccc(CSC2=Nc3cc(ccc3C(N2Cc2ccccc2)=O)C(NC2CCCC2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.7797 |
| logD: | 5.7797 |
| logSw: | -5.8812 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.276 |
| InChI Key: | NCQNMXQXPDVDCG-UHFFFAOYSA-N |