5-[(2,4-difluorophenyl)carbamamido]-2-(3,4-dihydroisoquinolin-2(1H)-yl)-N-(3-methoxypropyl)benzamide
Chemical Structure Depiction of
5-[(2,4-difluorophenyl)carbamamido]-2-(3,4-dihydroisoquinolin-2(1H)-yl)-N-(3-methoxypropyl)benzamide
5-[(2,4-difluorophenyl)carbamamido]-2-(3,4-dihydroisoquinolin-2(1H)-yl)-N-(3-methoxypropyl)benzamide
Compound characteristics
| Compound ID: | V011-0873 |
| Compound Name: | 5-[(2,4-difluorophenyl)carbamamido]-2-(3,4-dihydroisoquinolin-2(1H)-yl)-N-(3-methoxypropyl)benzamide |
| Molecular Weight: | 494.54 |
| Molecular Formula: | C27 H28 F2 N4 O3 |
| Salt: | not_available |
| Smiles: | COCCCNC(c1cc(ccc1N1CCc2ccccc2C1)NC(Nc1ccc(cc1F)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.049 |
| logD: | 5.0473 |
| logSw: | -4.5367 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 67.526 |
| InChI Key: | WWUGBNKXIGLJHB-UHFFFAOYSA-N |