N-[3-chloro-4-(morpholin-4-yl)phenyl]-2-[4-methyl-2-(4H-1,2,4-triazol-4-yl)phenoxy]acetamide
Chemical Structure Depiction of
N-[3-chloro-4-(morpholin-4-yl)phenyl]-2-[4-methyl-2-(4H-1,2,4-triazol-4-yl)phenoxy]acetamide
N-[3-chloro-4-(morpholin-4-yl)phenyl]-2-[4-methyl-2-(4H-1,2,4-triazol-4-yl)phenoxy]acetamide
Compound characteristics
| Compound ID: | J016-0092 |
| Compound Name: | N-[3-chloro-4-(morpholin-4-yl)phenyl]-2-[4-methyl-2-(4H-1,2,4-triazol-4-yl)phenoxy]acetamide |
| Molecular Weight: | 427.89 |
| Molecular Formula: | C21 H22 Cl N5 O3 |
| Smiles: | Cc1ccc(c(c1)n1cnnc1)OCC(Nc1ccc(c(c1)[Cl])N1CCOCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1375 |
| logD: | 3.1371 |
| logSw: | -3.3889 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.493 |
| InChI Key: | SBIPEMAQHSDSGM-UHFFFAOYSA-N |