4-methyl-N-(2-{[(5-methyl-1H-imidazol-4-yl)methyl]sulfanyl}ethyl)-3-(3H-[1,2,3]triazolo[4,5-b]pyridin-3-yl)benzamide
Chemical Structure Depiction of
4-methyl-N-(2-{[(5-methyl-1H-imidazol-4-yl)methyl]sulfanyl}ethyl)-3-(3H-[1,2,3]triazolo[4,5-b]pyridin-3-yl)benzamide
4-methyl-N-(2-{[(5-methyl-1H-imidazol-4-yl)methyl]sulfanyl}ethyl)-3-(3H-[1,2,3]triazolo[4,5-b]pyridin-3-yl)benzamide
Compound characteristics
| Compound ID: | F646-0644 |
| Compound Name: | 4-methyl-N-(2-{[(5-methyl-1H-imidazol-4-yl)methyl]sulfanyl}ethyl)-3-(3H-[1,2,3]triazolo[4,5-b]pyridin-3-yl)benzamide |
| Molecular Weight: | 407.5 |
| Molecular Formula: | C20 H21 N7 O S |
| Smiles: | Cc1ccc(cc1n1c2c(cccn2)nn1)C(NCCSCc1c(C)[nH]cn1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0474 |
| logD: | 1.6965 |
| logSw: | -2.4933 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.332 |
| InChI Key: | QBGXYYVJMAVPEA-UHFFFAOYSA-N |