3,5-dimethoxy-N-[3-(5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyridin-3-yl)phenyl]benzamide
Chemical Structure Depiction of
3,5-dimethoxy-N-[3-(5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyridin-3-yl)phenyl]benzamide
3,5-dimethoxy-N-[3-(5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyridin-3-yl)phenyl]benzamide
Compound characteristics
| Compound ID: | S346-0231 |
| Compound Name: | 3,5-dimethoxy-N-[3-(5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyridin-3-yl)phenyl]benzamide |
| Molecular Weight: | 378.43 |
| Molecular Formula: | C21 H22 N4 O3 |
| Smiles: | COc1cc(cc(c1)OC)C(Nc1cccc(c1)c1nnc2CCCCn12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4361 |
| logD: | 3.4335 |
| logSw: | -3.7167 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.11 |
| InChI Key: | UXOMBFWXTNSUQJ-UHFFFAOYSA-N |