N-butyl-2-[(4-fluorophenyl)methyl]-3-(4-methoxyphenyl)-N-methyl-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
N-butyl-2-[(4-fluorophenyl)methyl]-3-(4-methoxyphenyl)-N-methyl-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
N-butyl-2-[(4-fluorophenyl)methyl]-3-(4-methoxyphenyl)-N-methyl-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | C096-1475 |
| Compound Name: | N-butyl-2-[(4-fluorophenyl)methyl]-3-(4-methoxyphenyl)-N-methyl-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide |
| Molecular Weight: | 474.58 |
| Molecular Formula: | C29 H31 F N2 O3 |
| Smiles: | CCCCN(C)C(C1C(c2ccc(cc2)OC)N(Cc2ccc(cc2)F)C(c2ccccc12)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.8215 |
| logD: | 4.8215 |
| logSw: | -4.5513 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 39.595 |
| InChI Key: | CHDOYNQUNCTDOL-UHFFFAOYSA-N |