5-[(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)methylidene]-3-(3-nitrophenyl)-2-sulfanylidene-1,3-thiazolidin-4-one
Chemical Structure Depiction of
5-[(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)methylidene]-3-(3-nitrophenyl)-2-sulfanylidene-1,3-thiazolidin-4-one
5-[(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)methylidene]-3-(3-nitrophenyl)-2-sulfanylidene-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | 3229-2546 |
| Compound Name: | 5-[(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)methylidene]-3-(3-nitrophenyl)-2-sulfanylidene-1,3-thiazolidin-4-one |
| Molecular Weight: | 435.52 |
| Molecular Formula: | C22 H17 N3 O3 S2 |
| Smiles: | Cc1cc(\C=C2/C(N(C(=S)S2)c2cccc(c2)[N+]([O-])=O)=O)c(C)n1c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.6204 |
| logD: | 4.6204 |
| logSw: | -4.5397 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 51.877 |
| InChI Key: | YADWDLPWBYGWQZ-UHFFFAOYSA-N |