1-(3,4-dimethoxyphenyl)-2-{4-[4-(propan-2-yl)benzene-1-sulfonyl]piperazin-1-yl}ethan-1-one
Chemical Structure Depiction of
1-(3,4-dimethoxyphenyl)-2-{4-[4-(propan-2-yl)benzene-1-sulfonyl]piperazin-1-yl}ethan-1-one
1-(3,4-dimethoxyphenyl)-2-{4-[4-(propan-2-yl)benzene-1-sulfonyl]piperazin-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | K940-3740 |
| Compound Name: | 1-(3,4-dimethoxyphenyl)-2-{4-[4-(propan-2-yl)benzene-1-sulfonyl]piperazin-1-yl}ethan-1-one |
| Molecular Weight: | 446.56 |
| Molecular Formula: | C23 H30 N2 O5 S |
| Smiles: | CC(C)c1ccc(cc1)S(N1CCN(CC1)CC(c1ccc(c(c1)OC)OC)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3908 |
| logD: | 3.3908 |
| logSw: | -3.8376 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 63.998 |
| InChI Key: | MIRMQPDVNHSERO-UHFFFAOYSA-N |