4-[(2-chlorophenyl)sulfanyl]-3-nitro-N-[3-(2-oxopyrrolidin-1-yl)propyl]benzamide
Chemical Structure Depiction of
4-[(2-chlorophenyl)sulfanyl]-3-nitro-N-[3-(2-oxopyrrolidin-1-yl)propyl]benzamide
4-[(2-chlorophenyl)sulfanyl]-3-nitro-N-[3-(2-oxopyrrolidin-1-yl)propyl]benzamide
Compound characteristics
| Compound ID: | K781-2404 |
| Compound Name: | 4-[(2-chlorophenyl)sulfanyl]-3-nitro-N-[3-(2-oxopyrrolidin-1-yl)propyl]benzamide |
| Molecular Weight: | 433.91 |
| Molecular Formula: | C20 H20 Cl N3 O4 S |
| Smiles: | C1CC(N(C1)CCCNC(c1ccc(c(c1)[N+]([O-])=O)Sc1ccccc1[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1696 |
| logD: | 3.1696 |
| logSw: | -3.631 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.814 |
| InChI Key: | COUYBEKYCISKQX-UHFFFAOYSA-N |