2-[4-chloro-2-(4H-1,2,4-triazol-4-yl)phenoxy]-1-[4-(4-methoxyphenyl)piperazin-1-yl]ethan-1-one
Chemical Structure Depiction of
2-[4-chloro-2-(4H-1,2,4-triazol-4-yl)phenoxy]-1-[4-(4-methoxyphenyl)piperazin-1-yl]ethan-1-one
2-[4-chloro-2-(4H-1,2,4-triazol-4-yl)phenoxy]-1-[4-(4-methoxyphenyl)piperazin-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | J015-0429 |
| Compound Name: | 2-[4-chloro-2-(4H-1,2,4-triazol-4-yl)phenoxy]-1-[4-(4-methoxyphenyl)piperazin-1-yl]ethan-1-one |
| Molecular Weight: | 427.89 |
| Molecular Formula: | C21 H22 Cl N5 O3 |
| Smiles: | COc1ccc(cc1)N1CCN(CC1)C(COc1ccc(cc1n1cnnc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 2.2098 |
| logD: | 2.2094 |
| logSw: | -2.9835 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 60.48 |
| InChI Key: | AFZYKAAKROEFSW-UHFFFAOYSA-N |