ethyl N-[(2-acetamido-4-methoxy-1,3-benzothiazol-6-yl)carbamoyl]-beta-alaninate
Chemical Structure Depiction of
ethyl N-[(2-acetamido-4-methoxy-1,3-benzothiazol-6-yl)carbamoyl]-beta-alaninate
ethyl N-[(2-acetamido-4-methoxy-1,3-benzothiazol-6-yl)carbamoyl]-beta-alaninate
Compound characteristics
| Compound ID: | F690-0761 |
| Compound Name: | ethyl N-[(2-acetamido-4-methoxy-1,3-benzothiazol-6-yl)carbamoyl]-beta-alaninate |
| Molecular Weight: | 380.42 |
| Molecular Formula: | C16 H20 N4 O5 S |
| Smiles: | CCOC(CCNC(Nc1cc(c2c(c1)sc(NC(C)=O)n2)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8041 |
| logD: | 1.8041 |
| logSw: | -2.4806 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 95.56 |
| InChI Key: | WGZPUGDSDAJNPU-UHFFFAOYSA-N |