{4-[(2-chlorophenyl)sulfanyl]-3-nitrophenyl}(pyrrolidin-1-yl)methanone
Chemical Structure Depiction of
{4-[(2-chlorophenyl)sulfanyl]-3-nitrophenyl}(pyrrolidin-1-yl)methanone
{4-[(2-chlorophenyl)sulfanyl]-3-nitrophenyl}(pyrrolidin-1-yl)methanone
Compound characteristics
| Compound ID: | K672-0347 |
| Compound Name: | {4-[(2-chlorophenyl)sulfanyl]-3-nitrophenyl}(pyrrolidin-1-yl)methanone |
| Molecular Weight: | 362.83 |
| Molecular Formula: | C17 H15 Cl N2 O3 S |
| Smiles: | C1CCN(C1)C(c1ccc(c(c1)[N+]([O-])=O)Sc1ccccc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.3896 |
| logD: | 4.3896 |
| logSw: | -4.4991 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.062 |
| InChI Key: | VIPUYRZDCKMQRC-UHFFFAOYSA-N |