3-(2-{[3-(4-fluorophenyl)-1H-pyrazol-4-yl]methylidene}hydrazinyl)-4H-1,2,4-triazol-4-amine--hydrogen chloride (1/2)
Chemical Structure Depiction of
3-(2-{[3-(4-fluorophenyl)-1H-pyrazol-4-yl]methylidene}hydrazinyl)-4H-1,2,4-triazol-4-amine--hydrogen chloride (1/2)
3-(2-{[3-(4-fluorophenyl)-1H-pyrazol-4-yl]methylidene}hydrazinyl)-4H-1,2,4-triazol-4-amine--hydrogen chloride (1/2)
Compound characteristics
| Compound ID: | 8012-8762 |
| Compound Name: | 3-(2-{[3-(4-fluorophenyl)-1H-pyrazol-4-yl]methylidene}hydrazinyl)-4H-1,2,4-triazol-4-amine--hydrogen chloride (1/2) |
| Molecular Weight: | 359.19 |
| Molecular Formula: | C12 H11 F N8 |
| Salt: | 2HCl |
| Smiles: | C(\c1c[nH]nc1c1ccc(cc1)F)=N/Nc1nncn1N |
| Stereo: | ACHIRAL |
| logP: | 0.9802 |
| logD: | 0.9802 |
| logSw: | -1.2059 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 89.51 |
| InChI Key: | VAICIOUOSLUBQT-OMCISZLKSA-N |