1-[5-amino-3-(4-chlorophenyl)-1H-1,2,4-triazol-1-yl]-2-(4-methoxyphenyl)ethan-1-one
Chemical Structure Depiction of
1-[5-amino-3-(4-chlorophenyl)-1H-1,2,4-triazol-1-yl]-2-(4-methoxyphenyl)ethan-1-one
1-[5-amino-3-(4-chlorophenyl)-1H-1,2,4-triazol-1-yl]-2-(4-methoxyphenyl)ethan-1-one
Compound characteristics
| Compound ID: | D481-1985 |
| Compound Name: | 1-[5-amino-3-(4-chlorophenyl)-1H-1,2,4-triazol-1-yl]-2-(4-methoxyphenyl)ethan-1-one |
| Molecular Weight: | 342.78 |
| Molecular Formula: | C17 H15 Cl N4 O2 |
| Smiles: | COc1ccc(CC(n2c(N)nc(c3ccc(cc3)[Cl])n2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.2248 |
| logD: | 3.2222 |
| logSw: | -3.6567 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.863 |
| InChI Key: | CHHOAKRSQKZHCR-UHFFFAOYSA-N |