3-(3,5-dimethoxyphenyl)-1H-1,2,4-triazol-5-amine
Chemical Structure Depiction of
3-(3,5-dimethoxyphenyl)-1H-1,2,4-triazol-5-amine
3-(3,5-dimethoxyphenyl)-1H-1,2,4-triazol-5-amine
Compound characteristics
Compound ID: | K508-0025 |
Compound Name: | 3-(3,5-dimethoxyphenyl)-1H-1,2,4-triazol-5-amine |
Molecular Weight: | 220.23 |
Molecular Formula: | C10 H12 N4 O2 |
Smiles: | COc1cc(cc(c1)OC)c1nc(N)[nH]n1 |
Stereo: | ACHIRAL |
logP: | 1.3714 |
logD: | 1.3362 |
logSw: | -1.6972 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 69.577 |
InChI Key: | FIBKWABDIGWXFW-UHFFFAOYSA-N |