5-[(3-nitrophenyl)methylidene]-3-(propan-2-yl)-2-sulfanylidene-1,3-thiazolidin-4-one
Chemical Structure Depiction of
5-[(3-nitrophenyl)methylidene]-3-(propan-2-yl)-2-sulfanylidene-1,3-thiazolidin-4-one
5-[(3-nitrophenyl)methylidene]-3-(propan-2-yl)-2-sulfanylidene-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | 3215-0659 |
| Compound Name: | 5-[(3-nitrophenyl)methylidene]-3-(propan-2-yl)-2-sulfanylidene-1,3-thiazolidin-4-one |
| Molecular Weight: | 308.38 |
| Molecular Formula: | C13 H12 N2 O3 S2 |
| Smiles: | CC(C)N1C(/C(=C/c2cccc(c2)[N+]([O-])=O)SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3235 |
| logD: | 3.3235 |
| logSw: | -3.6029 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 49.816 |
| InChI Key: | VQHJLVXOYOBUFS-UHFFFAOYSA-N |