2-[(1,3-benzothiazol-2-yl)sulfanyl]propanoic acid
Chemical Structure Depiction of
2-[(1,3-benzothiazol-2-yl)sulfanyl]propanoic acid
2-[(1,3-benzothiazol-2-yl)sulfanyl]propanoic acid
Compound characteristics
| Compound ID: | 8010-3964 |
| Compound Name: | 2-[(1,3-benzothiazol-2-yl)sulfanyl]propanoic acid |
| Molecular Weight: | 239.31 |
| Molecular Formula: | C10 H9 N O2 S2 |
| Smiles: | CC(C(O)=O)Sc1nc2ccccc2s1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8224 |
| logD: | -0.3841 |
| logSw: | -3.1288 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.728 |
| InChI Key: | ZRMKAMAPVMHSFW-LURJTMIESA-N |