(3-chlorophenyl)methyl 3-{2-[(3-chlorophenyl)methyl]-2H-tetrazol-5-yl}benzoate
Chemical Structure Depiction of
(3-chlorophenyl)methyl 3-{2-[(3-chlorophenyl)methyl]-2H-tetrazol-5-yl}benzoate
(3-chlorophenyl)methyl 3-{2-[(3-chlorophenyl)methyl]-2H-tetrazol-5-yl}benzoate
Compound characteristics
Compound ID: | 8016-0068 |
Compound Name: | (3-chlorophenyl)methyl 3-{2-[(3-chlorophenyl)methyl]-2H-tetrazol-5-yl}benzoate |
Molecular Weight: | 439.3 |
Molecular Formula: | C22 H16 Cl2 N4 O2 |
Smiles: | C(c1cccc(c1)[Cl])n1nc(c2cccc(c2)C(=O)OCc2cccc(c2)[Cl])nn1 |
Stereo: | ACHIRAL |
logP: | 6.2013 |
logD: | 6.2013 |
logSw: | -6.4423 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 59.199 |
InChI Key: | XAGXFQFWPBUZLD-UHFFFAOYSA-N |