3-(1H-tetrazol-1-yl)phenyl (4-methoxyphenyl)acetate
Chemical Structure Depiction of
3-(1H-tetrazol-1-yl)phenyl (4-methoxyphenyl)acetate
3-(1H-tetrazol-1-yl)phenyl (4-methoxyphenyl)acetate
Compound characteristics
Compound ID: | D453-0717 |
Compound Name: | 3-(1H-tetrazol-1-yl)phenyl (4-methoxyphenyl)acetate |
Molecular Weight: | 310.31 |
Molecular Formula: | C16 H14 N4 O3 |
Smiles: | COc1ccc(CC(=O)Oc2cccc(c2)n2cnnn2)cc1 |
Stereo: | ACHIRAL |
logP: | 2.6003 |
logD: | 2.6003 |
logSw: | -2.9577 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 67.33 |
InChI Key: | XXUDYXPYLBQNDY-UHFFFAOYSA-N |