ethyl [(6-pentanamido-1,3-benzothiazol-2-yl)sulfanyl]acetate
Chemical Structure Depiction of
ethyl [(6-pentanamido-1,3-benzothiazol-2-yl)sulfanyl]acetate
ethyl [(6-pentanamido-1,3-benzothiazol-2-yl)sulfanyl]acetate
Compound characteristics
| Compound ID: | D336-5979 |
| Compound Name: | ethyl [(6-pentanamido-1,3-benzothiazol-2-yl)sulfanyl]acetate |
| Molecular Weight: | 352.47 |
| Molecular Formula: | C16 H20 N2 O3 S2 |
| Smiles: | CCCCC(Nc1ccc2c(c1)sc(n2)SCC(=O)OCC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0393 |
| logD: | 4.0393 |
| logSw: | -3.9642 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.628 |
| InChI Key: | NJSVUTYTBCWNRX-UHFFFAOYSA-N |