2-nitro-N-{4-oxo-2-sulfanylidene-5-[(3,4,5-trimethoxyphenyl)methylidene]-1,3-thiazolidin-3-yl}benzamide
Chemical Structure Depiction of
2-nitro-N-{4-oxo-2-sulfanylidene-5-[(3,4,5-trimethoxyphenyl)methylidene]-1,3-thiazolidin-3-yl}benzamide
2-nitro-N-{4-oxo-2-sulfanylidene-5-[(3,4,5-trimethoxyphenyl)methylidene]-1,3-thiazolidin-3-yl}benzamide
Compound characteristics
| Compound ID: | 2109-0464 |
| Compound Name: | 2-nitro-N-{4-oxo-2-sulfanylidene-5-[(3,4,5-trimethoxyphenyl)methylidene]-1,3-thiazolidin-3-yl}benzamide |
| Molecular Weight: | 475.5 |
| Molecular Formula: | C20 H17 N3 O7 S2 |
| Smiles: | COc1cc(/C=C2/C(N(C(=S)S2)NC(c2ccccc2[N+]([O-])=O)=O)=O)cc(c1OC)OC |
| Stereo: | ACHIRAL |
| logP: | 2.4676 |
| logD: | 1.2172 |
| logSw: | -3.1112 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 98.902 |
| InChI Key: | BXNZCJJHEYRUFA-UHFFFAOYSA-N |