1-{4-[(3-fluorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-[{2-hydroxy-3-[(prop-2-yn-1-yl)oxy]propyl}(2-methoxyethyl)amino]ethan-1-one
Chemical Structure Depiction of
1-{4-[(3-fluorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-[{2-hydroxy-3-[(prop-2-yn-1-yl)oxy]propyl}(2-methoxyethyl)amino]ethan-1-one
1-{4-[(3-fluorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-[{2-hydroxy-3-[(prop-2-yn-1-yl)oxy]propyl}(2-methoxyethyl)amino]ethan-1-one
Compound characteristics
| Compound ID: | V015-6943 |
| Compound Name: | 1-{4-[(3-fluorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-[{2-hydroxy-3-[(prop-2-yn-1-yl)oxy]propyl}(2-methoxyethyl)amino]ethan-1-one |
| Molecular Weight: | 490.59 |
| Molecular Formula: | C25 H31 F N2 O5 S |
| Salt: | not_available |
| Smiles: | COCCN(CC(COCC#C)O)CC(N1CCc2c(ccs2)C1COc1cccc(c1)F)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.718 |
| logD: | 2.7178 |
| logSw: | -2.9645 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.352 |
| InChI Key: | XSAWIFCLLBFUCS-UHFFFAOYSA-N |