N-[(2RS)-1-{[(4-methoxyphenyl)methyl]amino}-3-methyl-1-oxobutan-2-yl]-2,3-dihydro-1,4-benzodioxine-2-carboxamide
Chemical Structure Depiction of
N-[(2RS)-1-{[(4-methoxyphenyl)methyl]amino}-3-methyl-1-oxobutan-2-yl]-2,3-dihydro-1,4-benzodioxine-2-carboxamide
N-[(2RS)-1-{[(4-methoxyphenyl)methyl]amino}-3-methyl-1-oxobutan-2-yl]-2,3-dihydro-1,4-benzodioxine-2-carboxamide
Compound characteristics
Compound ID: | Y041-5168 |
Compound Name: | N-[(2RS)-1-{[(4-methoxyphenyl)methyl]amino}-3-methyl-1-oxobutan-2-yl]-2,3-dihydro-1,4-benzodioxine-2-carboxamide |
Molecular Weight: | 398.46 |
Molecular Formula: | C22 H26 N2 O5 |
Smiles: | CC(C)[C@H](C(NCc1ccc(cc1)OC)=O)NC(C1COc2ccccc2O1)=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 2.4479 |
logD: | 2.4479 |
logSw: | -2.6391 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 71.67 |
InChI Key: | AZCOILPFDMCEQE-GFOWMXPYSA-N |