2-[ethyl(2-hydroxy-3-phenylpropyl)amino]-1-{4-[(2-methoxyphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}ethan-1-one
Chemical Structure Depiction of
2-[ethyl(2-hydroxy-3-phenylpropyl)amino]-1-{4-[(2-methoxyphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}ethan-1-one
2-[ethyl(2-hydroxy-3-phenylpropyl)amino]-1-{4-[(2-methoxyphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}ethan-1-one
Compound characteristics
Compound ID: | V017-1509 |
Compound Name: | 2-[ethyl(2-hydroxy-3-phenylpropyl)amino]-1-{4-[(2-methoxyphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}ethan-1-one |
Molecular Weight: | 494.65 |
Molecular Formula: | C28 H34 N2 O4 S |
Salt: | not_available |
Smiles: | CCN(CC(Cc1ccccc1)O)CC(N1CCc2c(ccs2)C1COc1ccccc1OC)=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 4.555 |
logD: | 4.5499 |
logSw: | -4.2372 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 51.848 |
InChI Key: | XSDFBYVWSWWGRS-UHFFFAOYSA-N |