ethyl 3-[(1,3-benzothiazol-2-yl)amino]but-2-enoate
Chemical Structure Depiction of
ethyl 3-[(1,3-benzothiazol-2-yl)amino]but-2-enoate
ethyl 3-[(1,3-benzothiazol-2-yl)amino]but-2-enoate
Compound characteristics
| Compound ID: | C301-5585 |
| Compound Name: | ethyl 3-[(1,3-benzothiazol-2-yl)amino]but-2-enoate |
| Molecular Weight: | 262.33 |
| Molecular Formula: | C13 H14 N2 O2 S |
| Smiles: | CCOC(\C=C(/C)Nc1nc2ccccc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6849 |
| logD: | 3.6178 |
| logSw: | -3.8832 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.987 |
| InChI Key: | PEXJJBDUEWAEDL-UHFFFAOYSA-N |