4-(3,4-dihydroisoquinolin-2(1H)-yl)-N-[(4-fluorophenyl)methyl]-2-(4-methoxyphenyl)pyrimidine-5-carboxamide
Chemical Structure Depiction of
4-(3,4-dihydroisoquinolin-2(1H)-yl)-N-[(4-fluorophenyl)methyl]-2-(4-methoxyphenyl)pyrimidine-5-carboxamide
4-(3,4-dihydroisoquinolin-2(1H)-yl)-N-[(4-fluorophenyl)methyl]-2-(4-methoxyphenyl)pyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | V028-0747 |
| Compound Name: | 4-(3,4-dihydroisoquinolin-2(1H)-yl)-N-[(4-fluorophenyl)methyl]-2-(4-methoxyphenyl)pyrimidine-5-carboxamide |
| Molecular Weight: | 468.53 |
| Molecular Formula: | C28 H25 F N4 O2 |
| Salt: | not_available |
| Smiles: | COc1ccc(cc1)c1ncc(C(NCc2ccc(cc2)F)=O)c(n1)N1CCc2ccccc2C1 |
| Stereo: | ACHIRAL |
| logP: | 5.6377 |
| logD: | 5.6363 |
| logSw: | -5.3374 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.064 |
| InChI Key: | ZUMJTLKFPAJFGI-UHFFFAOYSA-N |