1-[(4-chlorophenyl)carbamoyl]-1-methyl-2-(4-methylphenyl)-3-oxo-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-5-ium--iodide (1/1)
Chemical Structure Depiction of
1-[(4-chlorophenyl)carbamoyl]-1-methyl-2-(4-methylphenyl)-3-oxo-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-5-ium--iodide (1/1)
1-[(4-chlorophenyl)carbamoyl]-1-methyl-2-(4-methylphenyl)-3-oxo-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-5-ium--iodide (1/1)
Compound characteristics
| Compound ID: | C623-1471 |
| Compound Name: | 1-[(4-chlorophenyl)carbamoyl]-1-methyl-2-(4-methylphenyl)-3-oxo-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-5-ium--iodide (1/1) |
| Molecular Weight: | 533.8 |
| Molecular Formula: | C23 H21 Cl N3 O2 |
| Salt: | I- |
| Smiles: | Cc1ccc(cc1)N1C(C[n+]2ccccc2C1(C)C(Nc1ccc(cc1)[Cl])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1525 |
| logD: | 4.1509 |
| logSw: | -4.5125 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.929 |
| InChI Key: | JSIVEEYGWOWJLH-HSZRJFAPSA-O |