N'-(2,5-difluorophenyl)-N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-N-(oxan-4-yl)urea
Chemical Structure Depiction of
N'-(2,5-difluorophenyl)-N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-N-(oxan-4-yl)urea
N'-(2,5-difluorophenyl)-N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-N-(oxan-4-yl)urea
Compound characteristics
| Compound ID: | SC12-0115 |
| Compound Name: | N'-(2,5-difluorophenyl)-N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-N-(oxan-4-yl)urea |
| Molecular Weight: | 429.51 |
| Molecular Formula: | C24 H29 F2 N3 O2 |
| Smiles: | C(CN1CCc2ccccc2C1)CN(C1CCOCC1)C(Nc1cc(ccc1F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3979 |
| logD: | 3.6133 |
| logSw: | -4.19 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 35.077 |
| InChI Key: | LJDVUWVYVJIFJX-UHFFFAOYSA-N |