7-hydroxy-3-[2-(propan-2-yl)phenoxy]-8-[(pyrrolidin-1-yl)methyl]-2-(trifluoromethyl)-4H-1-benzopyran-4-one
Chemical Structure Depiction of
7-hydroxy-3-[2-(propan-2-yl)phenoxy]-8-[(pyrrolidin-1-yl)methyl]-2-(trifluoromethyl)-4H-1-benzopyran-4-one
7-hydroxy-3-[2-(propan-2-yl)phenoxy]-8-[(pyrrolidin-1-yl)methyl]-2-(trifluoromethyl)-4H-1-benzopyran-4-one
Compound characteristics
| Compound ID: | 5694-1432 |
| Compound Name: | 7-hydroxy-3-[2-(propan-2-yl)phenoxy]-8-[(pyrrolidin-1-yl)methyl]-2-(trifluoromethyl)-4H-1-benzopyran-4-one |
| Molecular Weight: | 447.45 |
| Molecular Formula: | C24 H24 F3 N O4 |
| Smiles: | CC(C)c1ccccc1OC1=C(C(F)(F)F)Oc2c(ccc(c2CN2CCCC2)O)C1=O |
| Stereo: | ACHIRAL |
| logP: | 5.3049 |
| logD: | 3.9677 |
| logSw: | -5.0678 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.032 |
| InChI Key: | HFPMUGZCCXOEPI-UHFFFAOYSA-N |