N-(5-{[4-(diethylamino)phenyl]methylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)-4-nitrobenzamide
Chemical Structure Depiction of
N-(5-{[4-(diethylamino)phenyl]methylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)-4-nitrobenzamide
N-(5-{[4-(diethylamino)phenyl]methylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)-4-nitrobenzamide
Compound characteristics
| Compound ID: | 1977-0322 |
| Compound Name: | N-(5-{[4-(diethylamino)phenyl]methylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)-4-nitrobenzamide |
| Molecular Weight: | 456.54 |
| Molecular Formula: | C21 H20 N4 O4 S2 |
| Smiles: | CCN(CC)c1ccc(/C=C2/C(N(C(=S)S2)NC(c2ccc(cc2)[N+]([O-])=O)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.9128 |
| logD: | 3.8742 |
| logSw: | -4.1359 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.961 |
| InChI Key: | UKSUCYKOTIHRMR-UHFFFAOYSA-N |