1-[(4-chlorophenyl)carbamoyl]-2-(4-fluorophenyl)-1-methyl-3-oxo-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-5-ium--iodide (1/1)
Chemical Structure Depiction of
1-[(4-chlorophenyl)carbamoyl]-2-(4-fluorophenyl)-1-methyl-3-oxo-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-5-ium--iodide (1/1)
1-[(4-chlorophenyl)carbamoyl]-2-(4-fluorophenyl)-1-methyl-3-oxo-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-5-ium--iodide (1/1)
Compound characteristics
| Compound ID: | C623-1635 |
| Compound Name: | 1-[(4-chlorophenyl)carbamoyl]-2-(4-fluorophenyl)-1-methyl-3-oxo-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-5-ium--iodide (1/1) |
| Molecular Weight: | 537.76 |
| Molecular Formula: | C22 H18 Cl F N3 O2 |
| Salt: | I- |
| Smiles: | CC1(C(Nc2ccc(cc2)[Cl])=O)c2cccc[n+]2CC(N1c1ccc(cc1)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7582 |
| logD: | 3.7566 |
| logSw: | -4.3893 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.929 |
| InChI Key: | QHNZQQZRYMTXLO-JOCHJYFZSA-O |