N-[3-(1,3-benzothiazol-2-yl)phenyl]-3-bromo-4-ethoxybenzamide
Chemical Structure Depiction of
N-[3-(1,3-benzothiazol-2-yl)phenyl]-3-bromo-4-ethoxybenzamide
N-[3-(1,3-benzothiazol-2-yl)phenyl]-3-bromo-4-ethoxybenzamide
Compound characteristics
| Compound ID: | 2026-4106 |
| Compound Name: | N-[3-(1,3-benzothiazol-2-yl)phenyl]-3-bromo-4-ethoxybenzamide |
| Molecular Weight: | 453.36 |
| Molecular Formula: | C22 H17 Br N2 O2 S |
| Smiles: | CCOc1ccc(cc1[Br])C(Nc1cccc(c1)c1nc2ccccc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.3312 |
| logD: | 6.3311 |
| logSw: | -5.5726 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.989 |
| InChI Key: | VBBHYWPCNMGPAT-UHFFFAOYSA-N |