4-({[1-(4-fluorophenyl)-1H-tetrazol-5-yl]sulfanyl}methyl)benzoic acid
Chemical Structure Depiction of
4-({[1-(4-fluorophenyl)-1H-tetrazol-5-yl]sulfanyl}methyl)benzoic acid
4-({[1-(4-fluorophenyl)-1H-tetrazol-5-yl]sulfanyl}methyl)benzoic acid
Compound characteristics
| Compound ID: | 6646-0088 |
| Compound Name: | 4-({[1-(4-fluorophenyl)-1H-tetrazol-5-yl]sulfanyl}methyl)benzoic acid |
| Molecular Weight: | 330.34 |
| Molecular Formula: | C15 H11 F N4 O2 S |
| Smiles: | C(c1ccc(cc1)C(O)=O)Sc1nnnn1c1ccc(cc1)F |
| Stereo: | ACHIRAL |
| logP: | 3.097 |
| logD: | 0.1255 |
| logSw: | -3.1785 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.297 |
| InChI Key: | XXIHAMCWQINAKZ-UHFFFAOYSA-N |