N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-2-[(2,5-dimethylphenyl)methyl]-3-oxo-2,3,5,6,7,8-hexahydro[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide
Chemical Structure Depiction of
N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-2-[(2,5-dimethylphenyl)methyl]-3-oxo-2,3,5,6,7,8-hexahydro[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide
N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-2-[(2,5-dimethylphenyl)methyl]-3-oxo-2,3,5,6,7,8-hexahydro[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide
Compound characteristics
| Compound ID: | SC27-2115 |
| Compound Name: | N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-2-[(2,5-dimethylphenyl)methyl]-3-oxo-2,3,5,6,7,8-hexahydro[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide |
| Molecular Weight: | 409.49 |
| Molecular Formula: | C22 H27 N5 O3 |
| Smiles: | Cc1ccc(C)c(CN2C(N3CCCC(C3=N2)C(NCc2c(C)noc2C)=O)=O)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2619 |
| logD: | 3.2619 |
| logSw: | -3.1854 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.657 |
| InChI Key: | OZPSHSQHZTVCOB-GOSISDBHSA-N |