{5-chloro-2-[(4-methylphenyl)methanesulfonyl]pyrimidin-4-yl}(4-methylpiperazin-1-yl)methanone
Chemical Structure Depiction of
{5-chloro-2-[(4-methylphenyl)methanesulfonyl]pyrimidin-4-yl}(4-methylpiperazin-1-yl)methanone
{5-chloro-2-[(4-methylphenyl)methanesulfonyl]pyrimidin-4-yl}(4-methylpiperazin-1-yl)methanone
Compound characteristics
| Compound ID: | D233-0387 |
| Compound Name: | {5-chloro-2-[(4-methylphenyl)methanesulfonyl]pyrimidin-4-yl}(4-methylpiperazin-1-yl)methanone |
| Molecular Weight: | 408.91 |
| Molecular Formula: | C18 H21 Cl N4 O3 S |
| Smiles: | Cc1ccc(CS(c2ncc(c(C(N3CCN(C)CC3)=O)n2)[Cl])(=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 1.7461 |
| logD: | 1.6142 |
| logSw: | -2.6445 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 68.541 |
| InChI Key: | WXHJGNVRMSHOSK-UHFFFAOYSA-N |