2-{[3-(benzyloxy)-2-hydroxypropyl](propyl)amino}-1-{4-[(2,4-dimethylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}ethan-1-one
Chemical Structure Depiction of
2-{[3-(benzyloxy)-2-hydroxypropyl](propyl)amino}-1-{4-[(2,4-dimethylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}ethan-1-one
2-{[3-(benzyloxy)-2-hydroxypropyl](propyl)amino}-1-{4-[(2,4-dimethylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}ethan-1-one
Compound characteristics
| Compound ID: | V023-0171 |
| Compound Name: | 2-{[3-(benzyloxy)-2-hydroxypropyl](propyl)amino}-1-{4-[(2,4-dimethylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}ethan-1-one |
| Molecular Weight: | 536.73 |
| Molecular Formula: | C31 H40 N2 O4 S |
| Salt: | not_available |
| Smiles: | CCCN(CC(COCc1ccccc1)O)CC(N1CCc2c(ccs2)C1COc1ccc(C)cc1C)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.0669 |
| logD: | 6.0619 |
| logSw: | -5.427 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.906 |
| InChI Key: | XTIWKHOZTQKLTP-UHFFFAOYSA-N |