5-{[3-(2,4-dinitrophenoxy)phenyl]methylidene}-2-sulfanylidene-1,3-thiazolidin-4-one
Chemical Structure Depiction of
5-{[3-(2,4-dinitrophenoxy)phenyl]methylidene}-2-sulfanylidene-1,3-thiazolidin-4-one
5-{[3-(2,4-dinitrophenoxy)phenyl]methylidene}-2-sulfanylidene-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | 3229-1484 |
| Compound Name: | 5-{[3-(2,4-dinitrophenoxy)phenyl]methylidene}-2-sulfanylidene-1,3-thiazolidin-4-one |
| Molecular Weight: | 403.39 |
| Molecular Formula: | C16 H9 N3 O6 S2 |
| Smiles: | C(=C1/C(NC(=S)S1)=O)/c1cccc(c1)Oc1ccc(cc1[N+]([O-])=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.6128 |
| logD: | 1.2617 |
| logSw: | -3.2629 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 98.197 |
| InChI Key: | NJJKMLKEWRZUDT-UHFFFAOYSA-N |