5-{[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]amino}-5-oxopentanoic acid
Chemical Structure Depiction of
5-{[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]amino}-5-oxopentanoic acid
5-{[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]amino}-5-oxopentanoic acid
Compound characteristics
| Compound ID: | 4555-4294 |
| Compound Name: | 5-{[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]amino}-5-oxopentanoic acid |
| Molecular Weight: | 342.39 |
| Molecular Formula: | C13 H14 N2 O5 S2 |
| Smiles: | CS(c1ccc2c(c1)sc(NC(CCCC(O)=O)=O)n2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.2852 |
| logD: | -2.312 |
| logSw: | -2.2558 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 91.282 |
| InChI Key: | WFWNKNPDVIPUCP-UHFFFAOYSA-N |