2-(4-acetamidophenyl)-1-[(4-chlorophenyl)carbamoyl]-3-oxo-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-5-ium--iodide (1/1)
Chemical Structure Depiction of
2-(4-acetamidophenyl)-1-[(4-chlorophenyl)carbamoyl]-3-oxo-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-5-ium--iodide (1/1)
2-(4-acetamidophenyl)-1-[(4-chlorophenyl)carbamoyl]-3-oxo-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-5-ium--iodide (1/1)
Compound characteristics
| Compound ID: | C623-1070 |
| Compound Name: | 2-(4-acetamidophenyl)-1-[(4-chlorophenyl)carbamoyl]-3-oxo-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-5-ium--iodide (1/1) |
| Molecular Weight: | 562.79 |
| Molecular Formula: | C23 H20 Cl N4 O3 |
| Salt: | I- |
| Smiles: | CC(Nc1ccc(cc1)N1C(C(Nc2ccc(cc2)[Cl])=O)c2cccc[n+]2CC1=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3049 |
| logD: | 2.304 |
| logSw: | -3.1292 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.357 |
| InChI Key: | KLAOTVVEXXJHQU-JOCHJYFZSA-O |