3-[4-(4-chloro-3-methylbenzene-1-sulfonyl)piperazin-1-yl]-1-(3-methylbutyl)pyrrolidin-2-one
Chemical Structure Depiction of
3-[4-(4-chloro-3-methylbenzene-1-sulfonyl)piperazin-1-yl]-1-(3-methylbutyl)pyrrolidin-2-one
3-[4-(4-chloro-3-methylbenzene-1-sulfonyl)piperazin-1-yl]-1-(3-methylbutyl)pyrrolidin-2-one
Compound characteristics
| Compound ID: | T990-3575 |
| Compound Name: | 3-[4-(4-chloro-3-methylbenzene-1-sulfonyl)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(c1ccc(c(C)c1)[Cl])(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7369 |
| logD: | 3.7359 |
| logSw: | -4.025 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 51.55 |
| InChI Key: | QOBPPLDMWNBDGT-IBGZPJMESA-N |