5-{[3-(2,4-dinitrophenoxy)-4-methoxyphenyl]methylidene}-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-4-one
Chemical Structure Depiction of
5-{[3-(2,4-dinitrophenoxy)-4-methoxyphenyl]methylidene}-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-4-one
5-{[3-(2,4-dinitrophenoxy)-4-methoxyphenyl]methylidene}-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | 2151-0532 |
| Compound Name: | 5-{[3-(2,4-dinitrophenoxy)-4-methoxyphenyl]methylidene}-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-4-one |
| Molecular Weight: | 473.48 |
| Molecular Formula: | C20 H15 N3 O7 S2 |
| Smiles: | COc1ccc(/C=C2/C(N(CC=C)C(=S)S2)=O)cc1Oc1ccc(cc1[N+]([O-])=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.5342 |
| logD: | 4.5342 |
| logSw: | -4.5911 |
| Hydrogen bond acceptors count: | 15 |
| Polar surface area: | 97.706 |
| InChI Key: | VJGCVAGPVPRLSX-UHFFFAOYSA-N |