N-{4-[3-ethoxy-5-(3-methoxyphenyl)-1H-1,2,4-triazol-1-yl]phenyl}-3-methylbutanamide
Chemical Structure Depiction of
N-{4-[3-ethoxy-5-(3-methoxyphenyl)-1H-1,2,4-triazol-1-yl]phenyl}-3-methylbutanamide
N-{4-[3-ethoxy-5-(3-methoxyphenyl)-1H-1,2,4-triazol-1-yl]phenyl}-3-methylbutanamide
Compound characteristics
| Compound ID: | V006-1122 |
| Compound Name: | N-{4-[3-ethoxy-5-(3-methoxyphenyl)-1H-1,2,4-triazol-1-yl]phenyl}-3-methylbutanamide |
| Molecular Weight: | 394.47 |
| Molecular Formula: | C22 H26 N4 O3 |
| Salt: | not_available |
| Smiles: | CCOc1nc(c2cccc(c2)OC)n(c2ccc(cc2)NC(CC(C)C)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.0146 |
| logD: | 5.0146 |
| logSw: | -4.5783 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.507 |
| InChI Key: | HRHLYRUYDINWEX-UHFFFAOYSA-N |