N-phenyl-4-(thian-4-yl)piperazine-1-carboxamide
Chemical Structure Depiction of
N-phenyl-4-(thian-4-yl)piperazine-1-carboxamide
N-phenyl-4-(thian-4-yl)piperazine-1-carboxamide
Compound characteristics
| Compound ID: | Y600-5609 |
| Compound Name: | N-phenyl-4-(thian-4-yl)piperazine-1-carboxamide |
| Molecular Weight: | 305.44 |
| Molecular Formula: | C16 H23 N3 O S |
| Smiles: | C1CSCCC1N1CCN(CC1)C(Nc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0808 |
| logD: | 0.8379 |
| logSw: | -2.6042 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 28.8009 |
| InChI Key: | MCEMGAMXSNLFKJ-UHFFFAOYSA-N |