N-{5-[2-(2-{[4-(diethylamino)phenyl]methylidene}hydrazinyl)-2-oxoethyl]-1,3,4-thiadiazol-2-yl}-4-nitrobenzamide
Chemical Structure Depiction of
N-{5-[2-(2-{[4-(diethylamino)phenyl]methylidene}hydrazinyl)-2-oxoethyl]-1,3,4-thiadiazol-2-yl}-4-nitrobenzamide
N-{5-[2-(2-{[4-(diethylamino)phenyl]methylidene}hydrazinyl)-2-oxoethyl]-1,3,4-thiadiazol-2-yl}-4-nitrobenzamide
Compound characteristics
| Compound ID: | 1067-0696 |
| Compound Name: | N-{5-[2-(2-{[4-(diethylamino)phenyl]methylidene}hydrazinyl)-2-oxoethyl]-1,3,4-thiadiazol-2-yl}-4-nitrobenzamide |
| Molecular Weight: | 481.53 |
| Molecular Formula: | C22 H23 N7 O4 S |
| Smiles: | CCN(CC)c1ccc(/C=N/NC(Cc2nnc(NC(c3ccc(cc3)[N+]([O-])=O)=O)s2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.664 |
| logD: | 3.168 |
| logSw: | -3.8846 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 118.59 |
| InChI Key: | FXQBSBOLNSRDKR-UHFFFAOYSA-N |