5-[(4-chloro-3-nitrophenyl)methylidene]-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one
Chemical Structure Depiction of
5-[(4-chloro-3-nitrophenyl)methylidene]-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one
5-[(4-chloro-3-nitrophenyl)methylidene]-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | 1207-0088 |
| Compound Name: | 5-[(4-chloro-3-nitrophenyl)methylidene]-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one |
| Molecular Weight: | 314.77 |
| Molecular Formula: | C11 H7 Cl N2 O3 S2 |
| Smiles: | CN1C(/C(=C\c2ccc(c(c2)[N+]([O-])=O)[Cl])SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6776 |
| logD: | 2.6776 |
| logSw: | -3.5967 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 49.56 |
| InChI Key: | COHSHASOWICZRH-UHFFFAOYSA-N |