3-{2-[(4-chloro-3-nitrophenyl)methylidene]hydrazinyl}-5-methyl-4H-1,2,4-triazol-4-amine--hydrogen chloride (1/1)
Chemical Structure Depiction of
3-{2-[(4-chloro-3-nitrophenyl)methylidene]hydrazinyl}-5-methyl-4H-1,2,4-triazol-4-amine--hydrogen chloride (1/1)
3-{2-[(4-chloro-3-nitrophenyl)methylidene]hydrazinyl}-5-methyl-4H-1,2,4-triazol-4-amine--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 8002-5947 |
| Compound Name: | 3-{2-[(4-chloro-3-nitrophenyl)methylidene]hydrazinyl}-5-methyl-4H-1,2,4-triazol-4-amine--hydrogen chloride (1/1) |
| Molecular Weight: | 332.15 |
| Molecular Formula: | C10 H10 Cl N7 O2 |
| Salt: | HCl |
| Smiles: | Cc1nnc(N/N=C/c2ccc(c(c2)[N+]([O-])=O)[Cl])n1N |
| Stereo: | ACHIRAL |
| logP: | 1.0182 |
| logD: | 1.018 |
| logSw: | -2.7328 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 99.003 |
| InChI Key: | RTCSZKSKERTANQ-WLRTZDKTSA-N |