[5-amino-3-(4-fluorophenyl)-1H-1,2,4-triazol-1-yl](3,4-dimethoxyphenyl)methanone
Chemical Structure Depiction of
[5-amino-3-(4-fluorophenyl)-1H-1,2,4-triazol-1-yl](3,4-dimethoxyphenyl)methanone
[5-amino-3-(4-fluorophenyl)-1H-1,2,4-triazol-1-yl](3,4-dimethoxyphenyl)methanone
Compound characteristics
Compound ID: | D481-1946 |
Compound Name: | [5-amino-3-(4-fluorophenyl)-1H-1,2,4-triazol-1-yl](3,4-dimethoxyphenyl)methanone |
Molecular Weight: | 342.33 |
Molecular Formula: | C17 H15 F N4 O3 |
Smiles: | COc1ccc(cc1OC)C(n1c(N)nc(c2ccc(cc2)F)n1)=O |
Stereo: | ACHIRAL |
logP: | 2.1767 |
logD: | 2.1767 |
logSw: | -2.6538 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 73.108 |
InChI Key: | OMYLHOVANHPXFQ-UHFFFAOYSA-N |