8-[(dimethylamino)methyl]-7-hydroxy-3-[(naphthalen-2-yl)oxy]-2-(trifluoromethyl)-4H-1-benzopyran-4-one
Chemical Structure Depiction of
8-[(dimethylamino)methyl]-7-hydroxy-3-[(naphthalen-2-yl)oxy]-2-(trifluoromethyl)-4H-1-benzopyran-4-one
8-[(dimethylamino)methyl]-7-hydroxy-3-[(naphthalen-2-yl)oxy]-2-(trifluoromethyl)-4H-1-benzopyran-4-one
Compound characteristics
| Compound ID: | 3992-3522 |
| Compound Name: | 8-[(dimethylamino)methyl]-7-hydroxy-3-[(naphthalen-2-yl)oxy]-2-(trifluoromethyl)-4H-1-benzopyran-4-one |
| Molecular Weight: | 429.39 |
| Molecular Formula: | C23 H18 F3 N O4 |
| Smiles: | CN(C)Cc1c(ccc2C(C(=C(C(F)(F)F)Oc12)Oc1ccc2ccccc2c1)=O)O |
| Stereo: | ACHIRAL |
| logP: | 4.7736 |
| logD: | 3.9969 |
| logSw: | -5.0676 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.463 |
| InChI Key: | ZLDPDHWNKCMIBH-UHFFFAOYSA-N |