N'-[(4-fluorophenyl)methylidene]-2-({5-[(4-iodoanilino)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)propanehydrazide
Chemical Structure Depiction of
N'-[(4-fluorophenyl)methylidene]-2-({5-[(4-iodoanilino)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)propanehydrazide
N'-[(4-fluorophenyl)methylidene]-2-({5-[(4-iodoanilino)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)propanehydrazide
Compound characteristics
| Compound ID: | Y508-6912 |
| Compound Name: | N'-[(4-fluorophenyl)methylidene]-2-({5-[(4-iodoanilino)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)propanehydrazide |
| Molecular Weight: | 564.42 |
| Molecular Formula: | C22 H22 F I N6 O S |
| Smiles: | CC(C(N/N=C/c1ccc(cc1)F)=O)Sc1nnc(CNc2ccc(cc2)I)n1CC=C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2223 |
| logD: | 5.2219 |
| logSw: | -5.0197 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.289 |
| InChI Key: | DTDONZUDSCGEEE-HNNXBMFYSA-N |