4-({[1-(4-carbamoylphenyl)-1H-tetrazol-5-yl]sulfanyl}methyl)benzoic acid
Chemical Structure Depiction of
4-({[1-(4-carbamoylphenyl)-1H-tetrazol-5-yl]sulfanyl}methyl)benzoic acid
4-({[1-(4-carbamoylphenyl)-1H-tetrazol-5-yl]sulfanyl}methyl)benzoic acid
Compound characteristics
| Compound ID: | 6646-0019 |
| Compound Name: | 4-({[1-(4-carbamoylphenyl)-1H-tetrazol-5-yl]sulfanyl}methyl)benzoic acid |
| Molecular Weight: | 355.37 |
| Molecular Formula: | C16 H13 N5 O3 S |
| Smiles: | C(c1ccc(cc1)C(O)=O)Sc1nnnn1c1ccc(cc1)C(N)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7138 |
| logD: | -1.2577 |
| logSw: | -2.1528 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 102.356 |
| InChI Key: | QBPFMFRNLVTZFL-UHFFFAOYSA-N |