4-ethoxy-2-phenyl-N-(2,2,2-trifluoroethyl)-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidine-7-carboxamide
Chemical Structure Depiction of
4-ethoxy-2-phenyl-N-(2,2,2-trifluoroethyl)-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidine-7-carboxamide
4-ethoxy-2-phenyl-N-(2,2,2-trifluoroethyl)-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidine-7-carboxamide
Compound characteristics
| Compound ID: | SD54-0468 |
| Compound Name: | 4-ethoxy-2-phenyl-N-(2,2,2-trifluoroethyl)-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidine-7-carboxamide |
| Molecular Weight: | 393.41 |
| Molecular Formula: | C20 H22 F3 N3 O2 |
| Smiles: | CCOc1c2CCC(CCc2nc(c2ccccc2)n1)C(NCC(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5712 |
| logD: | 4.4882 |
| logSw: | -4.2828 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.856 |
| InChI Key: | DBTFUFIFLGLTRN-AWEZNQCLSA-N |