{4-[({4-[4-(2-chlorophenyl)piperazin-1-yl]-6-ethylpyrimidin-2-yl}sulfanyl)methyl]phenyl}(4-methylpiperazin-1-yl)methanone
Chemical Structure Depiction of
{4-[({4-[4-(2-chlorophenyl)piperazin-1-yl]-6-ethylpyrimidin-2-yl}sulfanyl)methyl]phenyl}(4-methylpiperazin-1-yl)methanone
{4-[({4-[4-(2-chlorophenyl)piperazin-1-yl]-6-ethylpyrimidin-2-yl}sulfanyl)methyl]phenyl}(4-methylpiperazin-1-yl)methanone
Compound characteristics
| Compound ID: | V027-8254 |
| Compound Name: | {4-[({4-[4-(2-chlorophenyl)piperazin-1-yl]-6-ethylpyrimidin-2-yl}sulfanyl)methyl]phenyl}(4-methylpiperazin-1-yl)methanone |
| Molecular Weight: | 551.15 |
| Molecular Formula: | C29 H35 Cl N6 O S |
| Salt: | not_available |
| Smiles: | CCc1cc(nc(n1)SCc1ccc(cc1)C(N1CCN(C)CC1)=O)N1CCN(CC1)c1ccccc1[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.1756 |
| logD: | 5.0449 |
| logSw: | -5.6903 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 43.756 |
| InChI Key: | UBXYCNYBMOZNNW-UHFFFAOYSA-N |