1-[(3-methylphenyl)methanesulfonyl]-N-{2-[(prop-2-en-1-yl)carbamoyl]phenyl}piperidine-4-carboxamide
Chemical Structure Depiction of
1-[(3-methylphenyl)methanesulfonyl]-N-{2-[(prop-2-en-1-yl)carbamoyl]phenyl}piperidine-4-carboxamide
1-[(3-methylphenyl)methanesulfonyl]-N-{2-[(prop-2-en-1-yl)carbamoyl]phenyl}piperidine-4-carboxamide
Compound characteristics
| Compound ID: | D356-0824 |
| Compound Name: | 1-[(3-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: | Cc1cccc(CS(N2CCC(CC2)C(Nc2ccccc2C(NCC=C)=O)=O)(=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 2.9228 |
| logD: | 2.9216 |
| logSw: | -3.5617 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.763 |
| InChI Key: | VCWILDDVQQVHQE-UHFFFAOYSA-N |