N-{4-[3-(2-methoxyethoxy)-5-(4-methoxyphenyl)-1H-1,2,4-triazol-1-yl]phenyl}-3-methylbutanamide
Chemical Structure Depiction of
N-{4-[3-(2-methoxyethoxy)-5-(4-methoxyphenyl)-1H-1,2,4-triazol-1-yl]phenyl}-3-methylbutanamide
N-{4-[3-(2-methoxyethoxy)-5-(4-methoxyphenyl)-1H-1,2,4-triazol-1-yl]phenyl}-3-methylbutanamide
Compound characteristics
| Compound ID: | V001-4421 |
| Compound Name: | N-{4-[3-(2-methoxyethoxy)-5-(4-methoxyphenyl)-1H-1,2,4-triazol-1-yl]phenyl}-3-methylbutanamide |
| Molecular Weight: | 424.5 |
| Molecular Formula: | C23 H28 N4 O4 |
| Salt: | not_available |
| Smiles: | CC(C)CC(Nc1ccc(cc1)n1c(c2ccc(cc2)OC)nc(n1)OCCOC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9772 |
| logD: | 3.9771 |
| logSw: | -4.211 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.143 |
| InChI Key: | KRDCNRLPSHVILD-UHFFFAOYSA-N |