2-[(4-fluorophenyl)methyl]-3-(4-methoxyphenyl)-1-oxo-N-(propan-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
2-[(4-fluorophenyl)methyl]-3-(4-methoxyphenyl)-1-oxo-N-(propan-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
2-[(4-fluorophenyl)methyl]-3-(4-methoxyphenyl)-1-oxo-N-(propan-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | C096-1449 |
| Compound Name: | 2-[(4-fluorophenyl)methyl]-3-(4-methoxyphenyl)-1-oxo-N-(propan-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide |
| Molecular Weight: | 446.52 |
| Molecular Formula: | C27 H27 F N2 O3 |
| Smiles: | CC(C)NC(C1C(c2ccc(cc2)OC)N(Cc2ccc(cc2)F)C(c2ccccc12)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.3342 |
| logD: | 4.3342 |
| logSw: | -4.3552 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.854 |
| InChI Key: | KCKJZJHKIIHETC-UHFFFAOYSA-N |