2-[ethyl(2-hydroxybutyl)amino]-1-[4-{[4-(propan-2-yl)phenoxy]methyl}-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]ethan-1-one
Chemical Structure Depiction of
2-[ethyl(2-hydroxybutyl)amino]-1-[4-{[4-(propan-2-yl)phenoxy]methyl}-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]ethan-1-one
2-[ethyl(2-hydroxybutyl)amino]-1-[4-{[4-(propan-2-yl)phenoxy]methyl}-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]ethan-1-one
Compound characteristics
| Compound ID: | V023-0147 |
| Compound Name: | 2-[ethyl(2-hydroxybutyl)amino]-1-[4-{[4-(propan-2-yl)phenoxy]methyl}-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]ethan-1-one |
| Molecular Weight: | 444.64 |
| Molecular Formula: | C25 H36 N2 O3 S |
| Salt: | not_available |
| Smiles: | CCC(CN(CC)CC(N1CCc2c(ccs2)C1COc1ccc(cc1)C(C)C)=O)O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.8338 |
| logD: | 4.8208 |
| logSw: | -4.2515 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.403 |
| InChI Key: | YKDCUEZJYOAUCL-UHFFFAOYSA-N |