1-[(4-chlorophenyl)carbamoyl]-2-(4-hydroxyphenyl)-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-hydroxyphenyl)-3-oxo-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-5-ium--iodide (1/1)
1-[(4-chlorophenyl)carbamoyl]-2-(4-hydroxyphenyl)-3-oxo-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-5-ium--iodide (1/1)
Compound characteristics
Compound ID: | C623-2701 |
Compound Name: | 1-[(4-chlorophenyl)carbamoyl]-2-(4-hydroxyphenyl)-3-oxo-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-5-ium--iodide (1/1) |
Molecular Weight: | 521.74 |
Molecular Formula: | C21 H17 Cl N3 O3 |
Salt: | I- |
Smiles: | C1C(N(C(C(Nc2ccc(cc2)[Cl])=O)c2cccc[n+]12)c1ccc(cc1)O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.4839 |
logD: | 2.4831 |
logSw: | -2.8819 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 57.712 |
InChI Key: | VCKDCUJMFBQWNM-HXUWFJFHSA-O |