4-[5-(benzylsulfanyl)-1H-tetrazol-1-yl]benzoic acid
Chemical Structure Depiction of
4-[5-(benzylsulfanyl)-1H-tetrazol-1-yl]benzoic acid
4-[5-(benzylsulfanyl)-1H-tetrazol-1-yl]benzoic acid
Compound characteristics
| Compound ID: | L150-0240 |
| Compound Name: | 4-[5-(benzylsulfanyl)-1H-tetrazol-1-yl]benzoic acid |
| Molecular Weight: | 312.35 |
| Molecular Formula: | C15 H12 N4 O2 S |
| Smiles: | C(c1ccccc1)Sc1nnnn1c1ccc(cc1)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.068 |
| logD: | 0.1818 |
| logSw: | -3.2497 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.297 |
| InChI Key: | KTBJFGYKICDIPM-UHFFFAOYSA-N |