ethyl N-[(2-benzamido-4-methoxy-1,3-benzothiazol-6-yl)carbamoyl]-beta-alaninate
Chemical Structure Depiction of
ethyl N-[(2-benzamido-4-methoxy-1,3-benzothiazol-6-yl)carbamoyl]-beta-alaninate
ethyl N-[(2-benzamido-4-methoxy-1,3-benzothiazol-6-yl)carbamoyl]-beta-alaninate
Compound characteristics
| Compound ID: | F690-0849 |
| Compound Name: | ethyl N-[(2-benzamido-4-methoxy-1,3-benzothiazol-6-yl)carbamoyl]-beta-alaninate |
| Molecular Weight: | 442.49 |
| Molecular Formula: | C21 H22 N4 O5 S |
| Smiles: | CCOC(CCNC(Nc1cc(c2c(c1)sc(NC(c1ccccc1)=O)n2)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2122 |
| logD: | 3.2111 |
| logSw: | -3.5232 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 95.389 |
| InChI Key: | HFSRIRFVXQSSEN-UHFFFAOYSA-N |