1-[(4-chlorophenyl)carbamoyl]-2-(3,4-dimethylphenyl)-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-(3,4-dimethylphenyl)-1-methyl-3-oxo-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-5-ium--iodide (1/1)
1-[(4-chlorophenyl)carbamoyl]-2-(3,4-dimethylphenyl)-1-methyl-3-oxo-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-5-ium--iodide (1/1)
Compound characteristics
| Compound ID: | C623-1527 |
| Compound Name: | 1-[(4-chlorophenyl)carbamoyl]-2-(3,4-dimethylphenyl)-1-methyl-3-oxo-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-5-ium--iodide (1/1) |
| Molecular Weight: | 547.82 |
| Molecular Formula: | C24 H23 Cl N3 O2 |
| Salt: | I- |
| Smiles: | Cc1ccc(cc1C)N1C(C[n+]2ccccc2C1(C)C(Nc1ccc(cc1)[Cl])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8616 |
| logD: | 4.86 |
| logSw: | -4.8215 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.929 |
| InChI Key: | NHOQGABQNCUYIL-XMMPIXPASA-O |