3-[4-(3-chloro-4-fluorobenzene-1-sulfonyl)piperazin-1-yl]-1-(3-methylbutyl)pyrrolidin-2-one
Chemical Structure Depiction of
3-[4-(3-chloro-4-fluorobenzene-1-sulfonyl)piperazin-1-yl]-1-(3-methylbutyl)pyrrolidin-2-one
3-[4-(3-chloro-4-fluorobenzene-1-sulfonyl)piperazin-1-yl]-1-(3-methylbutyl)pyrrolidin-2-one
Compound characteristics
| Compound ID: | T990-3815 |
| Compound Name: | 3-[4-(3-chloro-4-fluorobenzene-1-sulfonyl)piperazin-1-yl]-1-(3-methylbutyl)pyrrolidin-2-one |
| Molecular Weight: | 431.96 |
| Molecular Formula: | C19 H27 Cl F N3 O3 S |
| Smiles: | CC(C)CCN1CCC(C1=O)N1CCN(CC1)S(c1ccc(c(c1)[Cl])F)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.965 |
| logD: | 2.964 |
| logSw: | -3.4179 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 51.55 |
| InChI Key: | HOXDZHAEXCRUNH-SFHVURJKSA-N |