{1-[(4-methylphenyl)methanesulfonyl]piperidin-4-yl}[4-(3-phenylprop-2-en-1-yl)piperazin-1-yl]methanone
Chemical Structure Depiction of
{1-[(4-methylphenyl)methanesulfonyl]piperidin-4-yl}[4-(3-phenylprop-2-en-1-yl)piperazin-1-yl]methanone
{1-[(4-methylphenyl)methanesulfonyl]piperidin-4-yl}[4-(3-phenylprop-2-en-1-yl)piperazin-1-yl]methanone
Compound characteristics
| Compound ID: | D356-1116 |
| Compound Name: | {1-[(4-methylphenyl)methanesulfonyl]piperidin-4-yl}[4-(3-phenylprop-2-en-1-yl)piperazin-1-yl]methanone |
| Molecular Weight: | 481.66 |
| Molecular Formula: | C27 H35 N3 O3 S |
| Smiles: | Cc1ccc(CS(N2CCC(CC2)C(N2CCN(CC2)C/C=C/c2ccccc2)=O)(=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.4851 |
| logD: | 3.4791 |
| logSw: | -3.3886 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 52.011 |
| InChI Key: | DIQPPJBVKKPNED-UHFFFAOYSA-N |