4-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}benzoic acid
Chemical Structure Depiction of
4-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}benzoic acid
4-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}benzoic acid
Compound characteristics
| Compound ID: | 8010-0288 |
| Compound Name: | 4-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}benzoic acid |
| Molecular Weight: | 266.34 |
| Molecular Formula: | C11 H10 N2 O2 S2 |
| Smiles: | Cc1nnc(SCc2ccc(cc2)C(O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 2.2496 |
| logD: | -0.7219 |
| logSw: | -2.4336 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.047 |
| InChI Key: | GZXGETYLQOEMGT-UHFFFAOYSA-N |