N-benzyl-4-[({4-[4-(2-chlorophenyl)piperazin-1-yl]-5,6-dimethylpyrimidin-2-yl}sulfanyl)methyl]benzamide
Chemical Structure Depiction of
N-benzyl-4-[({4-[4-(2-chlorophenyl)piperazin-1-yl]-5,6-dimethylpyrimidin-2-yl}sulfanyl)methyl]benzamide
N-benzyl-4-[({4-[4-(2-chlorophenyl)piperazin-1-yl]-5,6-dimethylpyrimidin-2-yl}sulfanyl)methyl]benzamide
Compound characteristics
| Compound ID: | V023-6328 |
| Compound Name: | N-benzyl-4-[({4-[4-(2-chlorophenyl)piperazin-1-yl]-5,6-dimethylpyrimidin-2-yl}sulfanyl)methyl]benzamide |
| Molecular Weight: | 558.15 |
| Molecular Formula: | C31 H32 Cl N5 O S |
| Salt: | not_available |
| Smiles: | Cc1c(C)nc(nc1N1CCN(CC1)c1ccccc1[Cl])SCc1ccc(cc1)C(NCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.5916 |
| logD: | 6.5899 |
| logSw: | -6.0414 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.595 |
| InChI Key: | KSBLVBOOUPOWOO-UHFFFAOYSA-N |