3-[5-(ethylsulfanyl)-1H-tetrazol-1-yl]benzoic acid
Chemical Structure Depiction of
3-[5-(ethylsulfanyl)-1H-tetrazol-1-yl]benzoic acid
3-[5-(ethylsulfanyl)-1H-tetrazol-1-yl]benzoic acid
Compound characteristics
| Compound ID: | 6646-0066 |
| Compound Name: | 3-[5-(ethylsulfanyl)-1H-tetrazol-1-yl]benzoic acid |
| Molecular Weight: | 250.28 |
| Molecular Formula: | C10 H10 N4 O2 S |
| Smiles: | CCSc1nnnn1c1cccc(c1)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3458 |
| logD: | -1.7721 |
| logSw: | -2.3761 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.568 |
| InChI Key: | PHCKERRHPVHIAV-UHFFFAOYSA-N |