5-[(4-chloro-3-nitrophenyl)methylidene]-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-4-one
Chemical Structure Depiction of
5-[(4-chloro-3-nitrophenyl)methylidene]-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-4-one
5-[(4-chloro-3-nitrophenyl)methylidene]-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | 3229-0262 |
| Compound Name: | 5-[(4-chloro-3-nitrophenyl)methylidene]-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-4-one |
| Molecular Weight: | 340.8 |
| Molecular Formula: | C13 H9 Cl N2 O3 S2 |
| Smiles: | C=CCN1C(/C(=C\c2ccc(c(c2)[N+]([O-])=O)[Cl])SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 3.497 |
| logD: | 3.497 |
| logSw: | -3.975 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 49.773 |
| InChI Key: | DMCVWHOYYSZJET-UHFFFAOYSA-N |