N-{6-[2-(2,5-dimethoxyanilino)-2-oxoethyl]-1,3-benzothiazol-2-yl}-2-methylpropanamide
Chemical Structure Depiction of
N-{6-[2-(2,5-dimethoxyanilino)-2-oxoethyl]-1,3-benzothiazol-2-yl}-2-methylpropanamide
N-{6-[2-(2,5-dimethoxyanilino)-2-oxoethyl]-1,3-benzothiazol-2-yl}-2-methylpropanamide
Compound characteristics
| Compound ID: | F223-1235 |
| Compound Name: | N-{6-[2-(2,5-dimethoxyanilino)-2-oxoethyl]-1,3-benzothiazol-2-yl}-2-methylpropanamide |
| Molecular Weight: | 413.49 |
| Molecular Formula: | C21 H23 N3 O4 S |
| Smiles: | CC(C)C(Nc1nc2ccc(CC(Nc3cc(ccc3OC)OC)=O)cc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7611 |
| logD: | 3.7594 |
| logSw: | -4.0826 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.717 |
| InChI Key: | YQELATLBMIKXJA-UHFFFAOYSA-N |