8-[(dipropylamino)methyl]-7-hydroxy-3-[2-(propan-2-yl)phenoxy]-2-(trifluoromethyl)-4H-1-benzopyran-4-one
Chemical Structure Depiction of
8-[(dipropylamino)methyl]-7-hydroxy-3-[2-(propan-2-yl)phenoxy]-2-(trifluoromethyl)-4H-1-benzopyran-4-one
8-[(dipropylamino)methyl]-7-hydroxy-3-[2-(propan-2-yl)phenoxy]-2-(trifluoromethyl)-4H-1-benzopyran-4-one
Compound characteristics
| Compound ID: | 5847-0252 |
| Compound Name: | 8-[(dipropylamino)methyl]-7-hydroxy-3-[2-(propan-2-yl)phenoxy]-2-(trifluoromethyl)-4H-1-benzopyran-4-one |
| Molecular Weight: | 477.52 |
| Molecular Formula: | C26 H30 F3 N O4 |
| Smiles: | CCCN(CCC)Cc1c(ccc2C(C(=C(C(F)(F)F)Oc12)Oc1ccccc1C(C)C)=O)O |
| Stereo: | ACHIRAL |
| logP: | 6.4924 |
| logD: | 5.4124 |
| logSw: | -5.694 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.874 |
| InChI Key: | NRQSGEDSIQYKEJ-UHFFFAOYSA-N |