{3-amino-4-[(4-methylphenyl)sulfanyl]phenyl}[4-(5-chloro-2-methylphenyl)piperazin-1-yl]methanone
Chemical Structure Depiction of
{3-amino-4-[(4-methylphenyl)sulfanyl]phenyl}[4-(5-chloro-2-methylphenyl)piperazin-1-yl]methanone
{3-amino-4-[(4-methylphenyl)sulfanyl]phenyl}[4-(5-chloro-2-methylphenyl)piperazin-1-yl]methanone
Compound characteristics
| Compound ID: | K786-3658 |
| Compound Name: | {3-amino-4-[(4-methylphenyl)sulfanyl]phenyl}[4-(5-chloro-2-methylphenyl)piperazin-1-yl]methanone |
| Molecular Weight: | 452.02 |
| Molecular Formula: | C25 H26 Cl N3 O S |
| Smiles: | Cc1ccc(cc1)Sc1ccc(cc1N)C(N1CCN(CC1)c1cc(ccc1C)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 6.1188 |
| logD: | 6.1188 |
| logSw: | -6.1011 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 39.671 |
| InChI Key: | XQTVVNPOMNPVRH-UHFFFAOYSA-N |