3-{2-[(2-chloro-5-nitrophenyl)methylidene]hydrazinyl}-4H-1,2,4-triazol-4-amine--hydrogen chloride (1/1)
Chemical Structure Depiction of
3-{2-[(2-chloro-5-nitrophenyl)methylidene]hydrazinyl}-4H-1,2,4-triazol-4-amine--hydrogen chloride (1/1)
3-{2-[(2-chloro-5-nitrophenyl)methylidene]hydrazinyl}-4H-1,2,4-triazol-4-amine--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 8002-9424 |
| Compound Name: | 3-{2-[(2-chloro-5-nitrophenyl)methylidene]hydrazinyl}-4H-1,2,4-triazol-4-amine--hydrogen chloride (1/1) |
| Molecular Weight: | 318.12 |
| Molecular Formula: | C9 H8 Cl N7 O2 |
| Salt: | HCl |
| Smiles: | C(\c1cc(ccc1[Cl])[N+]([O-])=O)=N/Nc1nncn1N |
| Stereo: | ACHIRAL |
| logP: | 1.5198 |
| logD: | 1.5197 |
| logSw: | -2.6446 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 98.701 |
| InChI Key: | JNCUOQQULSWBQJ-UUILKARUSA-N |