8-[(dimethylamino)methyl]-3-(4-fluorophenyl)-7-hydroxy-2H-1-benzopyran-2-one
Chemical Structure Depiction of
8-[(dimethylamino)methyl]-3-(4-fluorophenyl)-7-hydroxy-2H-1-benzopyran-2-one
8-[(dimethylamino)methyl]-3-(4-fluorophenyl)-7-hydroxy-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | D635-0119 |
| Compound Name: | 8-[(dimethylamino)methyl]-3-(4-fluorophenyl)-7-hydroxy-2H-1-benzopyran-2-one |
| Molecular Weight: | 313.33 |
| Molecular Formula: | C18 H16 F N O3 |
| Smiles: | CN(C)Cc1c(ccc2C=C(C(=O)Oc12)c1ccc(cc1)F)O |
| Stereo: | ACHIRAL |
| logP: | 2.9488 |
| logD: | 2.6457 |
| logSw: | -3.2341 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.008 |
| InChI Key: | YNQQXOMKCPKVEG-UHFFFAOYSA-N |