2-bromo-N-{1-[4-(dimethylamino)phenyl]-3-(4-fluoroanilino)-3-oxoprop-1-en-2-yl}benzamide
Chemical Structure Depiction of
2-bromo-N-{1-[4-(dimethylamino)phenyl]-3-(4-fluoroanilino)-3-oxoprop-1-en-2-yl}benzamide
2-bromo-N-{1-[4-(dimethylamino)phenyl]-3-(4-fluoroanilino)-3-oxoprop-1-en-2-yl}benzamide
Compound characteristics
Compound ID: | 2628-3120 |
Compound Name: | 2-bromo-N-{1-[4-(dimethylamino)phenyl]-3-(4-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(Nc2ccc(cc2)F)=O)NC(c2ccccc2[Br])=O)cc1 |
Stereo: | ACHIRAL |
logP: | 4.7036 |
logD: | 4.1497 |
logSw: | -4.4881 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 48.059 |
InChI Key: | MTUDZNFMNPXVOQ-PXLXIMEGSA-N |