4,8-dimethyl-7-{2-oxo-2-[4-(pyrrolidin-1-yl)phenyl]ethoxy}-2H-1-benzopyran-2-one
Chemical Structure Depiction of
4,8-dimethyl-7-{2-oxo-2-[4-(pyrrolidin-1-yl)phenyl]ethoxy}-2H-1-benzopyran-2-one
4,8-dimethyl-7-{2-oxo-2-[4-(pyrrolidin-1-yl)phenyl]ethoxy}-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y040-3863 |
| Compound Name: | 4,8-dimethyl-7-{2-oxo-2-[4-(pyrrolidin-1-yl)phenyl]ethoxy}-2H-1-benzopyran-2-one |
| Molecular Weight: | 377.44 |
| Molecular Formula: | C23 H23 N O4 |
| Smiles: | CC1=CC(=O)Oc2c1ccc(c2C)OCC(c1ccc(cc1)N1CCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2185 |
| logD: | 4.2185 |
| logSw: | -4.3117 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 44.71 |
| InChI Key: | MOBIOXDAFCEWHM-UHFFFAOYSA-N |