4-{[2-(4-amino-5-ethyl-4H-1,2,4-triazol-3-yl)hydrazinylidene]methyl}-2-chloro-6-ethoxyphenol--hydrogen chloride (1/1)
Chemical Structure Depiction of
4-{[2-(4-amino-5-ethyl-4H-1,2,4-triazol-3-yl)hydrazinylidene]methyl}-2-chloro-6-ethoxyphenol--hydrogen chloride (1/1)
4-{[2-(4-amino-5-ethyl-4H-1,2,4-triazol-3-yl)hydrazinylidene]methyl}-2-chloro-6-ethoxyphenol--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 8019-4873 |
| Compound Name: | 4-{[2-(4-amino-5-ethyl-4H-1,2,4-triazol-3-yl)hydrazinylidene]methyl}-2-chloro-6-ethoxyphenol--hydrogen chloride (1/1) |
| Molecular Weight: | 361.23 |
| Molecular Formula: | C13 H17 Cl N6 O2 |
| Salt: | HCl |
| Smiles: | CCc1nnc(N/N=C/c2cc(c(c(c2)[Cl])O)OCC)n1N |
| Stereo: | ACHIRAL |
| logP: | 2.4263 |
| logD: | 2.4017 |
| logSw: | -3.0026 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 88.811 |
| InChI Key: | YKKBWMISAMXGRZ-FRKPEAEDSA-N |