2-butyl-1-[(2,6-dimethylphenyl)carbamoyl]-1-methyl-3-oxo-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-5-ium
Chemical Structure Depiction of
2-butyl-1-[(2,6-dimethylphenyl)carbamoyl]-1-methyl-3-oxo-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-5-ium
2-butyl-1-[(2,6-dimethylphenyl)carbamoyl]-1-methyl-3-oxo-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-5-ium
Compound characteristics
| Compound ID: | C623-2793 |
| Compound Name: | 2-butyl-1-[(2,6-dimethylphenyl)carbamoyl]-1-methyl-3-oxo-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-5-ium |
| Molecular Weight: | 493.39 |
| Molecular Formula: | C22 H28 N3 O2 |
| Salt: | I- |
| Smiles: | CCCCN1C(C[n+]2ccccc2C1(C)C(Nc1c(C)cccc1C)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2368 |
| logD: | 3.2367 |
| logSw: | -3.0892 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.395 |
| InChI Key: | OQMBBEMNMGTMBR-JOCHJYFZSA-O |