2-chlorophenyl 3-nitro-4-(2-oxopyrrolidin-1-yl)benzene-1-sulfonate
Chemical Structure Depiction of
2-chlorophenyl 3-nitro-4-(2-oxopyrrolidin-1-yl)benzene-1-sulfonate
2-chlorophenyl 3-nitro-4-(2-oxopyrrolidin-1-yl)benzene-1-sulfonate
Compound characteristics
| Compound ID: | 2759-0861 |
| Compound Name: | 2-chlorophenyl 3-nitro-4-(2-oxopyrrolidin-1-yl)benzene-1-sulfonate |
| Molecular Weight: | 396.8 |
| Molecular Formula: | C16 H13 Cl N2 O6 S |
| Smiles: | C1CC(N(C1)c1ccc(cc1[N+]([O-])=O)S(=O)(=O)Oc1ccccc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.1636 |
| logD: | 3.1636 |
| logSw: | -3.5043 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 85.683 |
| InChI Key: | BCYLVCZBKRSVGF-UHFFFAOYSA-N |