1-[(2-methylphenyl)methanesulfonyl]-N-{2-[(prop-2-en-1-yl)carbamoyl]phenyl}piperidine-4-carboxamide
Chemical Structure Depiction of
1-[(2-methylphenyl)methanesulfonyl]-N-{2-[(prop-2-en-1-yl)carbamoyl]phenyl}piperidine-4-carboxamide
1-[(2-methylphenyl)methanesulfonyl]-N-{2-[(prop-2-en-1-yl)carbamoyl]phenyl}piperidine-4-carboxamide
Compound characteristics
| Compound ID: | D356-0605 |
| Compound Name: | 1-[(2-methylphenyl)methanesulfonyl]-N-{2-[(prop-2-en-1-yl)carbamoyl]phenyl}piperidine-4-carboxamide |
| Molecular Weight: | 455.58 |
| Molecular Formula: | C24 H29 N3 O4 S |
| Smiles: | Cc1ccccc1CS(N1CCC(CC1)C(Nc1ccccc1C(NCC=C)=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9984 |
| logD: | 2.9972 |
| logSw: | -3.4763 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.763 |
| InChI Key: | JKWUCDDDZYMQNU-UHFFFAOYSA-N |