2-(4-ethoxyphenyl)-1-[(4-ethoxyphenyl)carbamoyl]-3-oxo-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-5-ium--iodide (1/1)
Chemical Structure Depiction of
2-(4-ethoxyphenyl)-1-[(4-ethoxyphenyl)carbamoyl]-3-oxo-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-5-ium--iodide (1/1)
2-(4-ethoxyphenyl)-1-[(4-ethoxyphenyl)carbamoyl]-3-oxo-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-5-ium--iodide (1/1)
Compound characteristics
| Compound ID: | C239-0761 |
| Compound Name: | 2-(4-ethoxyphenyl)-1-[(4-ethoxyphenyl)carbamoyl]-3-oxo-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-5-ium--iodide (1/1) |
| Molecular Weight: | 559.4 |
| Molecular Formula: | C25 H26 N3 O4 |
| Salt: | I- |
| Smiles: | CCOc1ccc(cc1)NC(C1c2cccc[n+]2CC(N1c1ccc(cc1)OCC)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2469 |
| logD: | 3.2469 |
| logSw: | -3.3609 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.342 |
| InChI Key: | HOXNWQFXBCVWEW-XMMPIXPASA-O |