N-{5-[(4-methoxyphenyl)methyl]-1H-1,2,4-triazol-3-yl}-3,5-dimethyl-1,2-oxazole-4-carboxamide
Chemical Structure Depiction of
N-{5-[(4-methoxyphenyl)methyl]-1H-1,2,4-triazol-3-yl}-3,5-dimethyl-1,2-oxazole-4-carboxamide
N-{5-[(4-methoxyphenyl)methyl]-1H-1,2,4-triazol-3-yl}-3,5-dimethyl-1,2-oxazole-4-carboxamide
Compound characteristics
| Compound ID: | Y041-8703 |
| Compound Name: | N-{5-[(4-methoxyphenyl)methyl]-1H-1,2,4-triazol-3-yl}-3,5-dimethyl-1,2-oxazole-4-carboxamide |
| Molecular Weight: | 327.34 |
| Molecular Formula: | C16 H17 N5 O3 |
| Smiles: | Cc1c(C(Nc2nc(Cc3ccc(cc3)OC)[nH]n2)=O)c(C)on1 |
| Stereo: | ACHIRAL |
| logP: | 2.3237 |
| logD: | 1.864 |
| logSw: | -2.8834 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.821 |
| InChI Key: | ZRYRAPJBBHZUDP-UHFFFAOYSA-N |