1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-4-[(morpholin-4-yl)methyl]-1H-1,2,3-triazole-5-carbohydrazide
Chemical Structure Depiction of
1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-4-[(morpholin-4-yl)methyl]-1H-1,2,3-triazole-5-carbohydrazide
1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-4-[(morpholin-4-yl)methyl]-1H-1,2,3-triazole-5-carbohydrazide
Compound characteristics
| Compound ID: | 2064-1388 |
| Compound Name: | 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-4-[(morpholin-4-yl)methyl]-1H-1,2,3-triazole-5-carbohydrazide |
| Molecular Weight: | 522.32 |
| Molecular Formula: | C18 H20 Br N9 O5 |
| Smiles: | COc1cc(/C=N/NC(c2c(CN3CCOCC3)nnn2c2c(N)non2)=O)cc(c1O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 0.6594 |
| logD: | 0.4609 |
| logSw: | -1.4754 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 152.92 |
| InChI Key: | HMPCQNPGIXIYRO-UHFFFAOYSA-N |