{4-[(2,5-difluorophenyl)methanesulfonyl]-3-nitrophenyl}(pyrrolidin-1-yl)methanone
Chemical Structure Depiction of
{4-[(2,5-difluorophenyl)methanesulfonyl]-3-nitrophenyl}(pyrrolidin-1-yl)methanone
{4-[(2,5-difluorophenyl)methanesulfonyl]-3-nitrophenyl}(pyrrolidin-1-yl)methanone
Compound characteristics
| Compound ID: | K673-0259 |
| Compound Name: | {4-[(2,5-difluorophenyl)methanesulfonyl]-3-nitrophenyl}(pyrrolidin-1-yl)methanone |
| Molecular Weight: | 410.39 |
| Molecular Formula: | C18 H16 F2 N2 O5 S |
| Smiles: | C1CCN(C1)C(c1ccc(c(c1)[N+]([O-])=O)S(Cc1cc(ccc1F)F)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2492 |
| logD: | 3.2492 |
| logSw: | -3.733 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 79.098 |
| InChI Key: | MPBILZIRZXHSDU-UHFFFAOYSA-N |