methyl 2-(4-chlorobenzamido)-3,3,3-trifluoro-2-(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)propanoate
Chemical Structure Depiction of
methyl 2-(4-chlorobenzamido)-3,3,3-trifluoro-2-(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)propanoate
methyl 2-(4-chlorobenzamido)-3,3,3-trifluoro-2-(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)propanoate
Compound characteristics
Compound ID: | 8014-1293 |
Compound Name: | methyl 2-(4-chlorobenzamido)-3,3,3-trifluoro-2-(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)propanoate |
Molecular Weight: | 433.81 |
Molecular Formula: | C19 H19 Cl F3 N O5 |
Smiles: | CC1(C)CC(=C(C(C1)=O)C(C(=O)OC)(C(F)(F)F)NC(c1ccc(cc1)[Cl])=O)O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.3172 |
logD: | -2.0741 |
logSw: | -3.5465 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 73.834 |
InChI Key: | SWBGCBRJKPFWEU-GOSISDBHSA-N |