methyl 2-[(1,3-benzothiazol-2-yl)sulfanyl]propanoate
Chemical Structure Depiction of
methyl 2-[(1,3-benzothiazol-2-yl)sulfanyl]propanoate
methyl 2-[(1,3-benzothiazol-2-yl)sulfanyl]propanoate
Compound characteristics
| Compound ID: | Y203-0075 |
| Compound Name: | methyl 2-[(1,3-benzothiazol-2-yl)sulfanyl]propanoate |
| Molecular Weight: | 253.34 |
| Molecular Formula: | C11 H11 N O2 S2 |
| Smiles: | CC(C(=O)OC)Sc1nc2ccccc2s1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5906 |
| logD: | 3.5906 |
| logSw: | -3.6672 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 30.4937 |
| InChI Key: | OFADSZGZEXEZIB-ZETCQYMHSA-N |