1-[5-amino-3-(2-methylphenyl)-1H-1,2,4-triazol-1-yl]-3-phenylpropan-1-one
Chemical Structure Depiction of
1-[5-amino-3-(2-methylphenyl)-1H-1,2,4-triazol-1-yl]-3-phenylpropan-1-one
1-[5-amino-3-(2-methylphenyl)-1H-1,2,4-triazol-1-yl]-3-phenylpropan-1-one
Compound characteristics
Compound ID: | D481-1846 |
Compound Name: | 1-[5-amino-3-(2-methylphenyl)-1H-1,2,4-triazol-1-yl]-3-phenylpropan-1-one |
Molecular Weight: | 306.37 |
Molecular Formula: | C18 H18 N4 O |
Smiles: | Cc1ccccc1c1nc(N)n(C(CCc2ccccc2)=O)n1 |
Stereo: | ACHIRAL |
logP: | 3.2071 |
logD: | 3.2071 |
logSw: | -3.4515 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 57.319 |
InChI Key: | WBHFMYDQLIFDOP-UHFFFAOYSA-N |