methyl phenyl[4-(2,4,6-trichlorobenzamido)cyclopent-2-en-1-yl]acetate
Chemical Structure Depiction of
methyl phenyl[4-(2,4,6-trichlorobenzamido)cyclopent-2-en-1-yl]acetate
methyl phenyl[4-(2,4,6-trichlorobenzamido)cyclopent-2-en-1-yl]acetate
Compound characteristics
| Compound ID: | V009-5251 |
| Compound Name: | methyl phenyl[4-(2,4,6-trichlorobenzamido)cyclopent-2-en-1-yl]acetate |
| Molecular Weight: | 438.74 |
| Molecular Formula: | C21 H18 Cl3 N O3 |
| Smiles: | COC(C(C1CC(C=C1)NC(c1c(cc(cc1[Cl])[Cl])[Cl])=O)c1ccccc1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.5842 |
| logD: | 5.5664 |
| logSw: | -6.3629 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.645 |
| InChI Key: | IUPWOGAGAVRLDL-UHFFFAOYSA-N |