3-[({4-[4-(2-chlorophenyl)piperazin-1-yl]-6-methylpyrimidin-2-yl}sulfanyl)methyl]-N-(2-methylpropyl)benzamide
Chemical Structure Depiction of
3-[({4-[4-(2-chlorophenyl)piperazin-1-yl]-6-methylpyrimidin-2-yl}sulfanyl)methyl]-N-(2-methylpropyl)benzamide
3-[({4-[4-(2-chlorophenyl)piperazin-1-yl]-6-methylpyrimidin-2-yl}sulfanyl)methyl]-N-(2-methylpropyl)benzamide
Compound characteristics
| Compound ID: | V002-2734 |
| Compound Name: | 3-[({4-[4-(2-chlorophenyl)piperazin-1-yl]-6-methylpyrimidin-2-yl}sulfanyl)methyl]-N-(2-methylpropyl)benzamide |
| Molecular Weight: | 510.1 |
| Molecular Formula: | C27 H32 Cl N5 O S |
| Salt: | not_available |
| Smiles: | CC(C)CNC(c1cccc(CSc2nc(C)cc(n2)N2CCN(CC2)c2ccccc2[Cl])c1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.2219 |
| logD: | 6.2216 |
| logSw: | -6.0652 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.627 |
| InChI Key: | SCMOLAURMHEIHK-UHFFFAOYSA-N |