3-{2-[(5-bromo-2-methoxyphenyl)methylidene]hydrazinyl}-5-methyl-4H-1,2,4-triazol-4-amine--hydrogen chloride (1/1)
Chemical Structure Depiction of
3-{2-[(5-bromo-2-methoxyphenyl)methylidene]hydrazinyl}-5-methyl-4H-1,2,4-triazol-4-amine--hydrogen chloride (1/1)
3-{2-[(5-bromo-2-methoxyphenyl)methylidene]hydrazinyl}-5-methyl-4H-1,2,4-triazol-4-amine--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | Y508-2023 |
| Compound Name: | 3-{2-[(5-bromo-2-methoxyphenyl)methylidene]hydrazinyl}-5-methyl-4H-1,2,4-triazol-4-amine--hydrogen chloride (1/1) |
| Molecular Weight: | 361.63 |
| Molecular Formula: | C11 H13 Br N6 O |
| Salt: | HCl |
| Smiles: | Cc1nnc(N/N=C/c2cc(ccc2OC)[Br])n1N |
| Stereo: | ACHIRAL |
| logP: | 1.8374 |
| logD: | 1.8371 |
| logSw: | -2.301 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 73.552 |
| InChI Key: | JQHGRPITSKIMBZ-MKMNVTDBSA-N |