3-(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-N-[2-(4-fluorophenyl)ethyl]-3-(4-hydroxy-6-methyl-2-oxo-2H-pyran-3-yl)propanamide
Chemical Structure Depiction of
3-(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-N-[2-(4-fluorophenyl)ethyl]-3-(4-hydroxy-6-methyl-2-oxo-2H-pyran-3-yl)propanamide
3-(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-N-[2-(4-fluorophenyl)ethyl]-3-(4-hydroxy-6-methyl-2-oxo-2H-pyran-3-yl)propanamide
Compound characteristics
Compound ID: | 8020-8613 |
Compound Name: | 3-(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-N-[2-(4-fluorophenyl)ethyl]-3-(4-hydroxy-6-methyl-2-oxo-2H-pyran-3-yl)propanamide |
Molecular Weight: | 499.49 |
Molecular Formula: | C26 H26 F N O8 |
Smiles: | CC1=CC(=C(C(CC(NCCc2ccc(cc2)F)=O)c2cc(c3c(c2OC)OCO3)OC)C(=O)O1)O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.1455 |
logD: | -0.8462 |
logSw: | -3.0611 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 93.744 |
InChI Key: | XABSKXNRMKMQKL-KRWDZBQOSA-N |