1-{4-[(4-chlorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-[(2-hydroxybutyl)(2-methoxyethyl)amino]ethan-1-one
Chemical Structure Depiction of
1-{4-[(4-chlorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-[(2-hydroxybutyl)(2-methoxyethyl)amino]ethan-1-one
1-{4-[(4-chlorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-[(2-hydroxybutyl)(2-methoxyethyl)amino]ethan-1-one
Compound characteristics
| Compound ID: | V016-5194 |
| Compound Name: | 1-{4-[(4-chlorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-[(2-hydroxybutyl)(2-methoxyethyl)amino]ethan-1-one |
| Molecular Weight: | 467.03 |
| Molecular Formula: | C23 H31 Cl N2 O4 S |
| Salt: | not_available |
| Smiles: | CCC(CN(CCOC)CC(N1CCc2c(ccs2)C1COc1ccc(cc1)[Cl])=O)O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.6507 |
| logD: | 3.6493 |
| logSw: | -3.7017 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.999 |
| InChI Key: | WTIUQBGGYRVVRG-UHFFFAOYSA-N |