1-[(4-chlorophenyl)carbamoyl]-2-(4-fluorophenyl)-3-oxo-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-5-ium
Chemical Structure Depiction of
1-[(4-chlorophenyl)carbamoyl]-2-(4-fluorophenyl)-3-oxo-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-5-ium
1-[(4-chlorophenyl)carbamoyl]-2-(4-fluorophenyl)-3-oxo-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-5-ium
Compound characteristics
| Compound ID: | C169-0266 |
| Compound Name: | 1-[(4-chlorophenyl)carbamoyl]-2-(4-fluorophenyl)-3-oxo-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-5-ium |
| Molecular Weight: | 523.73 |
| Molecular Formula: | C21 H16 Cl F N3 O2 |
| Salt: | I- |
| Smiles: | C1C(N(C(C(Nc2ccc(cc2)[Cl])=O)c2cccc[n+]12)c1ccc(cc1)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1328 |
| logD: | 3.1319 |
| logSw: | -3.5446 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.095 |
| InChI Key: | OSCDNOSEBPJDIW-HXUWFJFHSA-O |