3-(3,4-dimethoxyphenyl)-N-[(4-fluorophenyl)methyl]-2-methyl-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
3-(3,4-dimethoxyphenyl)-N-[(4-fluorophenyl)methyl]-2-methyl-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
3-(3,4-dimethoxyphenyl)-N-[(4-fluorophenyl)methyl]-2-methyl-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | C096-1308 |
| Compound Name: | 3-(3,4-dimethoxyphenyl)-N-[(4-fluorophenyl)methyl]-2-methyl-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide |
| Molecular Weight: | 448.49 |
| Molecular Formula: | C26 H25 F N2 O4 |
| Smiles: | CN1C(C(C(NCc2ccc(cc2)F)=O)c2ccccc2C1=O)c1ccc(c(c1)OC)OC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.7544 |
| logD: | 2.7543 |
| logSw: | -3.379 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.363 |
| InChI Key: | HKGFLESMVHNZJD-UHFFFAOYSA-N |