2-bromo-N-{1-[4-(dimethylamino)phenyl]-3-(3-fluoroanilino)-3-oxoprop-1-en-2-yl}benzamide
Chemical Structure Depiction of
2-bromo-N-{1-[4-(dimethylamino)phenyl]-3-(3-fluoroanilino)-3-oxoprop-1-en-2-yl}benzamide
2-bromo-N-{1-[4-(dimethylamino)phenyl]-3-(3-fluoroanilino)-3-oxoprop-1-en-2-yl}benzamide
Compound characteristics
| Compound ID: | 2399-2315 |
| Compound Name: | 2-bromo-N-{1-[4-(dimethylamino)phenyl]-3-(3-fluoroanilino)-3-oxoprop-1-en-2-yl}benzamide |
| Molecular Weight: | 482.35 |
| Molecular Formula: | C24 H21 Br F N3 O2 |
| Smiles: | CN(C)c1ccc(\C=C(/C(Nc2cccc(c2)F)=O)NC(c2ccccc2[Br])=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.828 |
| logD: | 4.2741 |
| logSw: | -4.5523 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 48.059 |
| InChI Key: | CCMWQDYDHPVBTK-UHFFFAOYSA-N |