2,2,2-trifluoroethyl 2-{[1-(2-chlorophenyl)-3-ethoxy-3-oxopropyl]carbamoyl}cyclohexane-1-carboxylate--hydrogen chloride (1/1)
Chemical Structure Depiction of
2,2,2-trifluoroethyl 2-{[1-(2-chlorophenyl)-3-ethoxy-3-oxopropyl]carbamoyl}cyclohexane-1-carboxylate--hydrogen chloride (1/1)
2,2,2-trifluoroethyl 2-{[1-(2-chlorophenyl)-3-ethoxy-3-oxopropyl]carbamoyl}cyclohexane-1-carboxylate--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 8014-9003 |
| Compound Name: | 2,2,2-trifluoroethyl 2-{[1-(2-chlorophenyl)-3-ethoxy-3-oxopropyl]carbamoyl}cyclohexane-1-carboxylate--hydrogen chloride (1/1) |
| Molecular Weight: | 500.34 |
| Molecular Formula: | C21 H25 Cl F3 N O5 |
| Salt: | HCl |
| Smiles: | CCOC(CC(c1ccccc1[Cl])NC(C1CCCCC1C(=O)OCC(F)(F)F)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.6597 |
| logD: | 4.6597 |
| logSw: | -4.6233 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.762 |
| InChI Key: | YETSFNAMGSRZAE-UHFFFAOYSA-N |