3-{4-[(2-chlorophenyl)methanesulfonyl]piperazin-1-yl}-1-(3-methylbutyl)pyrrolidin-2-one
Chemical Structure Depiction of
3-{4-[(2-chlorophenyl)methanesulfonyl]piperazin-1-yl}-1-(3-methylbutyl)pyrrolidin-2-one
3-{4-[(2-chlorophenyl)methanesulfonyl]piperazin-1-yl}-1-(3-methylbutyl)pyrrolidin-2-one
Compound characteristics
| Compound ID: | T990-3807 |
| Compound Name: | 3-{4-[(2-chlorophenyl)methanesulfonyl]piperazin-1-yl}-1-(3-methylbutyl)pyrrolidin-2-one |
| Molecular Weight: | 427.99 |
| Molecular Formula: | C20 H30 Cl N3 O3 S |
| Smiles: | CC(C)CCN1CCC(C1=O)N1CCN(CC1)S(Cc1ccccc1[Cl])(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9266 |
| logD: | 2.9258 |
| logSw: | -3.3158 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 51.445 |
| InChI Key: | YVCITTUPFOSEDU-IBGZPJMESA-N |