N-[2-(4-fluorophenyl)ethyl]-3-(4-hydroxy-2-oxo-2H-1-benzopyran-3-yl)-3-(7-methoxy-2H-1,3-benzodioxol-5-yl)propanamide
Chemical Structure Depiction of
N-[2-(4-fluorophenyl)ethyl]-3-(4-hydroxy-2-oxo-2H-1-benzopyran-3-yl)-3-(7-methoxy-2H-1,3-benzodioxol-5-yl)propanamide
N-[2-(4-fluorophenyl)ethyl]-3-(4-hydroxy-2-oxo-2H-1-benzopyran-3-yl)-3-(7-methoxy-2H-1,3-benzodioxol-5-yl)propanamide
Compound characteristics
| Compound ID: | 8020-8631 |
| Compound Name: | N-[2-(4-fluorophenyl)ethyl]-3-(4-hydroxy-2-oxo-2H-1-benzopyran-3-yl)-3-(7-methoxy-2H-1,3-benzodioxol-5-yl)propanamide |
| Molecular Weight: | 505.5 |
| Molecular Formula: | C28 H24 F N O7 |
| Smiles: | COc1cc(cc2c1OCO2)C(CC(NCCc1ccc(cc1)F)=O)C1=C(c2ccccc2OC1=O)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0387 |
| logD: | 0.5197 |
| logSw: | -3.5161 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.431 |
| InChI Key: | MWHWMPJNCVZHPM-FQEVSTJZSA-N |