N~1~-[(2-methoxyphenyl)methyl]-N~2~-{4-[(1H-1,2,4-triazol-1-yl)methyl]phenyl}ethanediamide
Chemical Structure Depiction of
N~1~-[(2-methoxyphenyl)methyl]-N~2~-{4-[(1H-1,2,4-triazol-1-yl)methyl]phenyl}ethanediamide
N~1~-[(2-methoxyphenyl)methyl]-N~2~-{4-[(1H-1,2,4-triazol-1-yl)methyl]phenyl}ethanediamide
Compound characteristics
| Compound ID: | IB08-1350 |
| Compound Name: | N~1~-[(2-methoxyphenyl)methyl]-N~2~-{4-[(1H-1,2,4-triazol-1-yl)methyl]phenyl}ethanediamide |
| Molecular Weight: | 365.39 |
| Molecular Formula: | C19 H19 N5 O3 |
| Smiles: | COc1ccccc1CNC(C(Nc1ccc(Cn2cncn2)cc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.25 |
| logD: | 1.2 |
| logSw: | -2.05 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 124.02 |
| InChI Key: | MKXXMTJSCOLHQV-UHFFFAOYSA-N |