1-[(4-chlorophenyl)carbamoyl]-2-(2-ethyl-6-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]-2-(2-ethyl-6-methylphenyl)-3-oxo-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-5-ium--iodide (1/1)
1-[(4-chlorophenyl)carbamoyl]-2-(2-ethyl-6-methylphenyl)-3-oxo-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-5-ium--iodide (1/1)
Compound characteristics
| Compound ID: | C623-2762 |
| Compound Name: | 1-[(4-chlorophenyl)carbamoyl]-2-(2-ethyl-6-methylphenyl)-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: | CCc1cccc(C)c1N1C(C(Nc2ccc(cc2)[Cl])=O)c2cccc[n+]2CC1=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4653 |
| logD: | 4.4644 |
| logSw: | -4.5204 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.493 |
| InChI Key: | QCMAHJDHKZHKHI-HSZRJFAPSA-O |