N-[5-(butan-2-yl)-2-hydroxyphenyl]-2-[4-chloro-2-(4H-1,2,4-triazol-4-yl)phenoxy]acetamide
Chemical Structure Depiction of
N-[5-(butan-2-yl)-2-hydroxyphenyl]-2-[4-chloro-2-(4H-1,2,4-triazol-4-yl)phenoxy]acetamide
N-[5-(butan-2-yl)-2-hydroxyphenyl]-2-[4-chloro-2-(4H-1,2,4-triazol-4-yl)phenoxy]acetamide
Compound characteristics
| Compound ID: | J015-0389 |
| Compound Name: | N-[5-(butan-2-yl)-2-hydroxyphenyl]-2-[4-chloro-2-(4H-1,2,4-triazol-4-yl)phenoxy]acetamide |
| Molecular Weight: | 400.86 |
| Molecular Formula: | C20 H21 Cl N4 O3 |
| Smiles: | CCC(C)c1ccc(c(c1)NC(COc1ccc(cc1n1cnnc1)[Cl])=O)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7991 |
| logD: | 3.7988 |
| logSw: | -4.245 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.283 |
| InChI Key: | GSTORJSDAKTVBZ-ZDUSSCGKSA-N |