1-[5-amino-3-(3-methylphenyl)-1H-1,2,4-triazol-1-yl]-2-(4-methoxyphenyl)ethan-1-one
Chemical Structure Depiction of
1-[5-amino-3-(3-methylphenyl)-1H-1,2,4-triazol-1-yl]-2-(4-methoxyphenyl)ethan-1-one
1-[5-amino-3-(3-methylphenyl)-1H-1,2,4-triazol-1-yl]-2-(4-methoxyphenyl)ethan-1-one
Compound characteristics
| Compound ID: | D481-1891 |
| Compound Name: | 1-[5-amino-3-(3-methylphenyl)-1H-1,2,4-triazol-1-yl]-2-(4-methoxyphenyl)ethan-1-one |
| Molecular Weight: | 322.36 |
| Molecular Formula: | C18 H18 N4 O2 |
| Smiles: | Cc1cccc(c1)c1nc(N)n(C(Cc2ccc(cc2)OC)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.9994 |
| logD: | 2.9967 |
| logSw: | -3.0533 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.863 |
| InChI Key: | BWKJTHHPNQRCCO-UHFFFAOYSA-N |