ethyl N-[(4-methoxy-2-propanamido-1,3-benzothiazol-6-yl)carbamoyl]-beta-alaninate
Chemical Structure Depiction of
ethyl N-[(4-methoxy-2-propanamido-1,3-benzothiazol-6-yl)carbamoyl]-beta-alaninate
ethyl N-[(4-methoxy-2-propanamido-1,3-benzothiazol-6-yl)carbamoyl]-beta-alaninate
Compound characteristics
| Compound ID: | F690-0665 |
| Compound Name: | ethyl N-[(4-methoxy-2-propanamido-1,3-benzothiazol-6-yl)carbamoyl]-beta-alaninate |
| Molecular Weight: | 394.45 |
| Molecular Formula: | C17 H22 N4 O5 S |
| Smiles: | CCC(Nc1nc2c(cc(cc2s1)NC(NCCC(=O)OCC)=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0956 |
| logD: | 2.0956 |
| logSw: | -2.854 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 95.447 |
| InChI Key: | WNAWMCOLYZBKDC-UHFFFAOYSA-N |