({2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-2-oxoethyl}sulfanyl)acetic acid
Chemical Structure Depiction of
({2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-2-oxoethyl}sulfanyl)acetic acid
({2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-2-oxoethyl}sulfanyl)acetic acid
Compound characteristics
| Compound ID: | Y205-5435 |
| Compound Name: | ({2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-2-oxoethyl}sulfanyl)acetic acid |
| Molecular Weight: | 342.84 |
| Molecular Formula: | C15 H19 Cl N2 O3 S |
| Smiles: | Cc1ccc(cc1N1CCN(CC1)C(CSCC(O)=O)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.4082 |
| logD: | -0.9604 |
| logSw: | -2.6404 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.974 |
| InChI Key: | XHMFJGGFOGSMTE-UHFFFAOYSA-N |