N-(2,6-dimethylphenyl)-5-methyl-1-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
N-(2,6-dimethylphenyl)-5-methyl-1-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]-1H-1,2,3-triazole-4-carboxamide
N-(2,6-dimethylphenyl)-5-methyl-1-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
Compound ID: | G684-0460 |
Compound Name: | N-(2,6-dimethylphenyl)-5-methyl-1-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]-1H-1,2,3-triazole-4-carboxamide |
Molecular Weight: | 401.47 |
Molecular Formula: | C23 H23 N5 O2 |
Smiles: | Cc1cccc(C)c1NC(c1c(C)n(Cc2c(C)oc(c3ccccc3)n2)nn1)=O |
Stereo: | ACHIRAL |
logP: | 3.2843 |
logD: | 3.2841 |
logSw: | -3.2967 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 66.763 |
InChI Key: | ILGSAUDVXQRQGP-UHFFFAOYSA-N |