2-(4-fluorophenyl)-4-oxo-N-(2-phenoxyethyl)-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidine-7-carboxamide
Chemical Structure Depiction of
2-(4-fluorophenyl)-4-oxo-N-(2-phenoxyethyl)-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidine-7-carboxamide
2-(4-fluorophenyl)-4-oxo-N-(2-phenoxyethyl)-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidine-7-carboxamide
Compound characteristics
| Compound ID: | SB25-1093 |
| Compound Name: | 2-(4-fluorophenyl)-4-oxo-N-(2-phenoxyethyl)-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidine-7-carboxamide |
| Molecular Weight: | 421.47 |
| Molecular Formula: | C24 H24 F N3 O3 |
| Smiles: | C1CC2=C(CCC1C(NCCOc1ccccc1)=O)N=C(c1ccc(cc1)F)NC2=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3637 |
| logD: | 2.2823 |
| logSw: | -3.3965 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.865 |
| InChI Key: | QBIQOKZBQAOKAU-QGZVFWFLSA-N |