2-{[5-(4-bromophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(5-methylthiophen-2-yl)methylidene]acetohydrazide
Chemical Structure Depiction of
2-{[5-(4-bromophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(5-methylthiophen-2-yl)methylidene]acetohydrazide
2-{[5-(4-bromophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(5-methylthiophen-2-yl)methylidene]acetohydrazide
Compound characteristics
| Compound ID: | 3254-2118 |
| Compound Name: | 2-{[5-(4-bromophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(5-methylthiophen-2-yl)methylidene]acetohydrazide |
| Molecular Weight: | 512.45 |
| Molecular Formula: | C22 H18 Br N5 O S2 |
| Smiles: | Cc1ccc(\C=N/NC(CSc2nnc(c3ccc(cc3)[Br])n2c2ccccc2)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 5.9631 |
| logD: | 5.9631 |
| logSw: | -5.5981 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.105 |
| InChI Key: | CXBDSIJUECEFRY-UHFFFAOYSA-N |