1-{4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydroquinoxalin-2-yl}-N-[3-(propylsulfanyl)propyl]piperidine-4-carboxamide
Chemical Structure Depiction of
1-{4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydroquinoxalin-2-yl}-N-[3-(propylsulfanyl)propyl]piperidine-4-carboxamide
1-{4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydroquinoxalin-2-yl}-N-[3-(propylsulfanyl)propyl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | F448-1042 |
| Compound Name: | 1-{4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydroquinoxalin-2-yl}-N-[3-(propylsulfanyl)propyl]piperidine-4-carboxamide |
| Molecular Weight: | 492.68 |
| Molecular Formula: | C28 H36 N4 O2 S |
| Smiles: | CCCSCCCNC(C1CCN(CC1)C1C(N(Cc2ccc(C)cc2)c2ccccc2N=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2228 |
| logD: | 4.2227 |
| logSw: | -3.9693 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.746 |
| InChI Key: | DSLPMBOEMKTSTJ-UHFFFAOYSA-N |