methyl 3-[4-(5-chloro-2-methylphenyl)piperazine-1-sulfonyl]thiophene-2-carboxylate
Chemical Structure Depiction of
methyl 3-[4-(5-chloro-2-methylphenyl)piperazine-1-sulfonyl]thiophene-2-carboxylate
methyl 3-[4-(5-chloro-2-methylphenyl)piperazine-1-sulfonyl]thiophene-2-carboxylate
Compound characteristics
| Compound ID: | G225-0085 |
| Compound Name: | methyl 3-[4-(5-chloro-2-methylphenyl)piperazine-1-sulfonyl]thiophene-2-carboxylate |
| Molecular Weight: | 414.93 |
| Molecular Formula: | C17 H19 Cl N2 O4 S2 |
| Smiles: | Cc1ccc(cc1N1CCN(CC1)S(c1ccsc1C(=O)OC)(=O)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.8778 |
| logD: | 3.8778 |
| logSw: | -4.3115 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 57.101 |
| InChI Key: | ARYBVMMZNAFURV-UHFFFAOYSA-N |