N-(2-methoxy-5-nitrophenyl)-3-(4-methoxyphenyl)-2-methyl-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
N-(2-methoxy-5-nitrophenyl)-3-(4-methoxyphenyl)-2-methyl-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
N-(2-methoxy-5-nitrophenyl)-3-(4-methoxyphenyl)-2-methyl-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Compound characteristics
Compound ID: | C096-1197 |
Compound Name: | N-(2-methoxy-5-nitrophenyl)-3-(4-methoxyphenyl)-2-methyl-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide |
Molecular Weight: | 461.47 |
Molecular Formula: | C25 H23 N3 O6 |
Smiles: | CN1C(C(C(Nc2cc(ccc2OC)[N+]([O-])=O)=O)c2ccccc2C1=O)c1ccc(cc1)OC |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 3.5451 |
logD: | 2.9961 |
logSw: | -3.8692 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 86.637 |
InChI Key: | QMXGJSYNQBKHFM-UHFFFAOYSA-N |