N-[(5-bromo-2-methoxyphenyl)methyl]-3-methyl-4-(3H-[1,2,3]triazolo[4,5-b]pyridin-3-yl)benzamide
Chemical Structure Depiction of
N-[(5-bromo-2-methoxyphenyl)methyl]-3-methyl-4-(3H-[1,2,3]triazolo[4,5-b]pyridin-3-yl)benzamide
N-[(5-bromo-2-methoxyphenyl)methyl]-3-methyl-4-(3H-[1,2,3]triazolo[4,5-b]pyridin-3-yl)benzamide
Compound characteristics
| Compound ID: | F617-1077 |
| Compound Name: | N-[(5-bromo-2-methoxyphenyl)methyl]-3-methyl-4-(3H-[1,2,3]triazolo[4,5-b]pyridin-3-yl)benzamide |
| Molecular Weight: | 452.31 |
| Molecular Formula: | C21 H18 Br N5 O2 |
| Smiles: | Cc1cc(ccc1n1c2c(cccn2)nn1)C(NCc1cc(ccc1OC)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.6377 |
| logD: | 3.6376 |
| logSw: | -3.9228 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.45 |
| InChI Key: | ZARLXZBSGAQPJT-UHFFFAOYSA-N |