1-{4-[(4-chlorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-[(3-ethoxy-2-hydroxypropyl)(propan-2-yl)amino]ethan-1-one
Chemical Structure Depiction of
1-{4-[(4-chlorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-[(3-ethoxy-2-hydroxypropyl)(propan-2-yl)amino]ethan-1-one
1-{4-[(4-chlorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-[(3-ethoxy-2-hydroxypropyl)(propan-2-yl)amino]ethan-1-one
Compound characteristics
| Compound ID: | V022-1923 |
| Compound Name: | 1-{4-[(4-chlorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-[(3-ethoxy-2-hydroxypropyl)(propan-2-yl)amino]ethan-1-one |
| Molecular Weight: | 481.05 |
| Molecular Formula: | C24 H33 Cl N2 O4 S |
| Salt: | not_available |
| Smiles: | CCOCC(CN(CC(N1CCc2c(ccs2)C1COc1ccc(cc1)[Cl])=O)C(C)C)O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.0699 |
| logD: | 4.0572 |
| logSw: | -4.1612 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.372 |
| InChI Key: | BNTHIQDVVCNFLR-UHFFFAOYSA-N |