2-{[5-(4-tert-butylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-{[4-(diethylamino)phenyl]methylidene}acetohydrazide
Chemical Structure Depiction of
2-{[5-(4-tert-butylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-{[4-(diethylamino)phenyl]methylidene}acetohydrazide
2-{[5-(4-tert-butylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-{[4-(diethylamino)phenyl]methylidene}acetohydrazide
Compound characteristics
| Compound ID: | 3254-1638 |
| Compound Name: | 2-{[5-(4-tert-butylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-{[4-(diethylamino)phenyl]methylidene}acetohydrazide |
| Molecular Weight: | 540.73 |
| Molecular Formula: | C31 H36 N6 O S |
| Smiles: | CCN(CC)c1ccc(/C=N/NC(CSc2nnc(c3ccc(cc3)C(C)(C)C)n2c2ccccc2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 7.095 |
| logD: | 7.0921 |
| logSw: | -5.7921 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.823 |
| InChI Key: | GAOORKJQVDHYLK-UHFFFAOYSA-N |