1-{3-[4-(2-chlorobenzene-1-sulfonyl)piperazin-1-yl]-3-ethylpyrrolidin-1-yl}-2-methylpropan-1-one
Chemical Structure Depiction of
1-{3-[4-(2-chlorobenzene-1-sulfonyl)piperazin-1-yl]-3-ethylpyrrolidin-1-yl}-2-methylpropan-1-one
1-{3-[4-(2-chlorobenzene-1-sulfonyl)piperazin-1-yl]-3-ethylpyrrolidin-1-yl}-2-methylpropan-1-one
Compound characteristics
Compound ID: | T833-1155 |
Compound Name: | 1-{3-[4-(2-chlorobenzene-1-sulfonyl)piperazin-1-yl]-3-ethylpyrrolidin-1-yl}-2-methylpropan-1-one |
Molecular Weight: | 427.99 |
Molecular Formula: | C20 H30 Cl N3 O3 S |
Smiles: | CCC1(CCN(C1)C(C(C)C)=O)N1CCN(CC1)S(c1ccccc1[Cl])(=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.0845 |
logD: | 3.0739 |
logSw: | -3.3894 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 52.018 |
InChI Key: | QRJGHLNBLDWOSY-FQEVSTJZSA-N |