2-(4-fluorophenyl)-4-oxo-N-[3-(2-oxopyrrolidin-1-yl)propyl]-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidine-7-carboxamide
Chemical Structure Depiction of
2-(4-fluorophenyl)-4-oxo-N-[3-(2-oxopyrrolidin-1-yl)propyl]-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidine-7-carboxamide
2-(4-fluorophenyl)-4-oxo-N-[3-(2-oxopyrrolidin-1-yl)propyl]-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidine-7-carboxamide
Compound characteristics
| Compound ID: | SB25-0905 |
| Compound Name: | 2-(4-fluorophenyl)-4-oxo-N-[3-(2-oxopyrrolidin-1-yl)propyl]-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidine-7-carboxamide |
| Molecular Weight: | 426.49 |
| Molecular Formula: | C23 H27 F N4 O3 |
| Smiles: | C1CC(N(C1)CCCNC(C1CCC2=C(CC1)N=C(c1ccc(cc1)F)NC2=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.8238 |
| logD: | -0.2576 |
| logSw: | -1.903 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.96 |
| InChI Key: | CVBOPJKQOVDDJU-MRXNPFEDSA-N |