N-butyl-2-[(2-chloro-6-fluorophenyl)methyl]-N-ethyl-3-oxo-2,3,5,6,7,8-hexahydro[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide
Chemical Structure Depiction of
N-butyl-2-[(2-chloro-6-fluorophenyl)methyl]-N-ethyl-3-oxo-2,3,5,6,7,8-hexahydro[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide
N-butyl-2-[(2-chloro-6-fluorophenyl)methyl]-N-ethyl-3-oxo-2,3,5,6,7,8-hexahydro[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide
Compound characteristics
| Compound ID: | SC27-2178 |
| Compound Name: | N-butyl-2-[(2-chloro-6-fluorophenyl)methyl]-N-ethyl-3-oxo-2,3,5,6,7,8-hexahydro[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide |
| Molecular Weight: | 408.9 |
| Molecular Formula: | C20 H26 Cl F N4 O2 |
| Smiles: | CCCCN(CC)C(C1CCCN2C1=NN(Cc1c(cccc1[Cl])F)C2=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0777 |
| logD: | 4.0777 |
| logSw: | -4.3596 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 48.391 |
| InChI Key: | ZAMUNQIFRHZRFN-CQSZACIVSA-N |