1-(2-{[(4-methylphenyl)methyl]sulfanyl}-4-oxo-3-pentyl-3,4-dihydroquinazoline-7-carbonyl)piperidine-4-carboxamide
Chemical Structure Depiction of
1-(2-{[(4-methylphenyl)methyl]sulfanyl}-4-oxo-3-pentyl-3,4-dihydroquinazoline-7-carbonyl)piperidine-4-carboxamide
1-(2-{[(4-methylphenyl)methyl]sulfanyl}-4-oxo-3-pentyl-3,4-dihydroquinazoline-7-carbonyl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | K289-0373 |
| Compound Name: | 1-(2-{[(4-methylphenyl)methyl]sulfanyl}-4-oxo-3-pentyl-3,4-dihydroquinazoline-7-carbonyl)piperidine-4-carboxamide |
| Molecular Weight: | 506.67 |
| Molecular Formula: | C28 H34 N4 O3 S |
| Smiles: | CCCCCN1C(=Nc2cc(ccc2C1=O)C(N1CCC(CC1)C(N)=O)=O)SCc1ccc(C)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.7511 |
| logD: | 3.7511 |
| logSw: | -3.7835 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.728 |
| InChI Key: | WBIHKSCGADOOLL-UHFFFAOYSA-N |