N-{6-[2-(4-bromo-3-methylanilino)-2-oxoethyl]-1,3-benzothiazol-2-yl}-2-methylpropanamide
Chemical Structure Depiction of
N-{6-[2-(4-bromo-3-methylanilino)-2-oxoethyl]-1,3-benzothiazol-2-yl}-2-methylpropanamide
N-{6-[2-(4-bromo-3-methylanilino)-2-oxoethyl]-1,3-benzothiazol-2-yl}-2-methylpropanamide
Compound characteristics
| Compound ID: | F223-1256 |
| Compound Name: | N-{6-[2-(4-bromo-3-methylanilino)-2-oxoethyl]-1,3-benzothiazol-2-yl}-2-methylpropanamide |
| Molecular Weight: | 446.36 |
| Molecular Formula: | C20 H20 Br N3 O2 S |
| Smiles: | CC(C)C(Nc1nc2ccc(CC(Nc3ccc(c(C)c3)[Br])=O)cc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2523 |
| logD: | 5.252 |
| logSw: | -5.0565 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.24 |
| InChI Key: | NDRZAWMSGIYNBT-UHFFFAOYSA-N |