1-[(4-chlorophenyl)carbamoyl]-2-(4-methoxyphenyl)-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-methoxyphenyl)-3-oxo-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-5-ium--iodide (1/1)
1-[(4-chlorophenyl)carbamoyl]-2-(4-methoxyphenyl)-3-oxo-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-5-ium--iodide (1/1)
Compound characteristics
| Compound ID: | C169-0261 |
| Compound Name: | 1-[(4-chlorophenyl)carbamoyl]-2-(4-methoxyphenyl)-3-oxo-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-5-ium--iodide (1/1) |
| Molecular Weight: | 535.77 |
| Molecular Formula: | C22 H19 Cl N3 O3 |
| Salt: | I- |
| Smiles: | COc1ccc(cc1)N1C(C(Nc2ccc(cc2)[Cl])=O)c2cccc[n+]2CC1=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0861 |
| logD: | 3.0852 |
| logSw: | -3.5551 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.639 |
| InChI Key: | BRQOODOKPXAVRN-OAQYLSRUSA-O |