4-(1,3-benzothiazol-2-yl)butanoic acid
Chemical Structure Depiction of
4-(1,3-benzothiazol-2-yl)butanoic acid
4-(1,3-benzothiazol-2-yl)butanoic acid
Compound characteristics
| Compound ID: | Y043-0179 |
| Compound Name: | 4-(1,3-benzothiazol-2-yl)butanoic acid |
| Molecular Weight: | 221.27 |
| Molecular Formula: | C11 H11 N O2 S |
| Smiles: | C(CC(O)=O)Cc1nc2ccccc2s1 |
| Stereo: | ACHIRAL |
| logP: | 2.3301 |
| logD: | -0.4436 |
| logSw: | -2.4667 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.838 |
| InChI Key: | DOTLYHUQAIHKEV-UHFFFAOYSA-N |