diethyl {2-benzamido-3-oxo-1-phenyl-3-[3-(trifluoromethyl)anilino]prop-1-en-1-yl}phosphonate
Chemical Structure Depiction of
diethyl {2-benzamido-3-oxo-1-phenyl-3-[3-(trifluoromethyl)anilino]prop-1-en-1-yl}phosphonate
diethyl {2-benzamido-3-oxo-1-phenyl-3-[3-(trifluoromethyl)anilino]prop-1-en-1-yl}phosphonate
Compound characteristics
Compound ID: | 4476-4367 |
Compound Name: | diethyl {2-benzamido-3-oxo-1-phenyl-3-[3-(trifluoromethyl)anilino]prop-1-en-1-yl}phosphonate |
Molecular Weight: | 546.48 |
Molecular Formula: | C27 H26 F3 N2 O5 P |
Smiles: | CCOP(C(=C(\C(Nc1cccc(c1)C(F)(F)F)=O)NC(c1ccccc1)=O)\c1ccccc1)(=O)OCC |
Stereo: | ACHIRAL |
logP: | 5.0575 |
logD: | 4.6327 |
logSw: | -4.8652 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 78.145 |
InChI Key: | STJAGBWKUWZBJL-UHFFFAOYSA-N |