{4-[(4-methylphenyl)methanesulfonyl]-3-nitrophenyl}[4-(pyridin-2-yl)piperazin-1-yl]methanone
Chemical Structure Depiction of
{4-[(4-methylphenyl)methanesulfonyl]-3-nitrophenyl}[4-(pyridin-2-yl)piperazin-1-yl]methanone
{4-[(4-methylphenyl)methanesulfonyl]-3-nitrophenyl}[4-(pyridin-2-yl)piperazin-1-yl]methanone
Compound characteristics
| Compound ID: | K673-0164 |
| Compound Name: | {4-[(4-methylphenyl)methanesulfonyl]-3-nitrophenyl}[4-(pyridin-2-yl)piperazin-1-yl]methanone |
| Molecular Weight: | 480.54 |
| Molecular Formula: | C24 H24 N4 O5 S |
| Smiles: | Cc1ccc(CS(c2ccc(cc2[N+]([O-])=O)C(N2CCN(CC2)c2ccccn2)=O)(=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.514 |
| logD: | 3.5052 |
| logSw: | -3.9297 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 90.504 |
| InChI Key: | VRNDKDVKYRWMMH-UHFFFAOYSA-N |