1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-({3-bromo-4-[(2-chlorophenyl)methoxy]-5-methoxyphenyl}methylidene)-5-methyl-1H-1,2,3-triazole-4-carbohydrazide
Chemical Structure Depiction of
1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-({3-bromo-4-[(2-chlorophenyl)methoxy]-5-methoxyphenyl}methylidene)-5-methyl-1H-1,2,3-triazole-4-carbohydrazide
1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-({3-bromo-4-[(2-chlorophenyl)methoxy]-5-methoxyphenyl}methylidene)-5-methyl-1H-1,2,3-triazole-4-carbohydrazide
Compound characteristics
| Compound ID: | K089-0027 |
| Compound Name: | 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-({3-bromo-4-[(2-chlorophenyl)methoxy]-5-methoxyphenyl}methylidene)-5-methyl-1H-1,2,3-triazole-4-carbohydrazide |
| Molecular Weight: | 561.78 |
| Molecular Formula: | C21 H18 Br Cl N8 O4 |
| Smiles: | Cc1c(C(N/N=C/c2cc(c(c(c2)[Br])OCc2ccccc2[Cl])OC)=O)nnn1c1c(N)non1 |
| Stereo: | ACHIRAL |
| logP: | 3.9049 |
| logD: | 3.8619 |
| logSw: | -4.3282 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 133.676 |
| InChI Key: | QICOMRLDLWDOBH-UHFFFAOYSA-N |