2-[(3-fluorophenyl)methyl]-3-oxo-N-{3-[(propan-2-yl)oxy]propyl}-2,3,5,6,7,8-hexahydro[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide
Chemical Structure Depiction of
2-[(3-fluorophenyl)methyl]-3-oxo-N-{3-[(propan-2-yl)oxy]propyl}-2,3,5,6,7,8-hexahydro[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide
2-[(3-fluorophenyl)methyl]-3-oxo-N-{3-[(propan-2-yl)oxy]propyl}-2,3,5,6,7,8-hexahydro[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide
Compound characteristics
| Compound ID: | SC27-1943 |
| Compound Name: | 2-[(3-fluorophenyl)methyl]-3-oxo-N-{3-[(propan-2-yl)oxy]propyl}-2,3,5,6,7,8-hexahydro[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide |
| Molecular Weight: | 390.46 |
| Molecular Formula: | C20 H27 F N4 O3 |
| Smiles: | CC(C)OCCCNC(C1CCCN2C1=NN(Cc1cccc(c1)F)C2=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.27 |
| logD: | 2.27 |
| logSw: | -2.7746 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.933 |
| InChI Key: | VTQPPDILKQYFTL-QGZVFWFLSA-N |