rel-(3R,4S)-3-(4-chlorobenzene-1-sulfonyl)-4-[4-(2,3-dimethylphenyl)piperazin-1-yl]-1lambda~6~-thiolane-1,1-dione
Chemical Structure Depiction of
rel-(3R,4S)-3-(4-chlorobenzene-1-sulfonyl)-4-[4-(2,3-dimethylphenyl)piperazin-1-yl]-1lambda~6~-thiolane-1,1-dione
rel-(3R,4S)-3-(4-chlorobenzene-1-sulfonyl)-4-[4-(2,3-dimethylphenyl)piperazin-1-yl]-1lambda~6~-thiolane-1,1-dione
Compound characteristics
| Compound ID: | D470-2236 |
| Compound Name: | rel-(3R,4S)-3-(4-chlorobenzene-1-sulfonyl)-4-[4-(2,3-dimethylphenyl)piperazin-1-yl]-1lambda~6~-thiolane-1,1-dione |
| Molecular Weight: | 483.05 |
| Molecular Formula: | C22 H27 Cl N2 O4 S2 |
| Smiles: | Cc1cccc(c1C)N1CCN(CC1)[C@H]1CS(C[C@@H]1S(c1ccc(cc1)[Cl])(=O)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 3.4327 |
| logD: | 3.4327 |
| logSw: | -3.706 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 63.887 |
| InChI Key: | VFWFARGHWGVISV-VXKWHMMOSA-N |