3-bromo-N-(2-{4-[(4-chlorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-(2-methylbutyl)benzamide
Chemical Structure Depiction of
3-bromo-N-(2-{4-[(4-chlorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-(2-methylbutyl)benzamide
3-bromo-N-(2-{4-[(4-chlorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-(2-methylbutyl)benzamide
Compound characteristics
Compound ID: | V012-3612 |
Compound Name: | 3-bromo-N-(2-{4-[(4-chlorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-(2-methylbutyl)benzamide |
Molecular Weight: | 589.98 |
Molecular Formula: | C28 H30 Br Cl N2 O3 S |
Smiles: | CCC(C)CN(CC(N1CCc2c(ccs2)C1COc1ccc(cc1)[Cl])=O)C(c1cccc(c1)[Br])=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 7.1172 |
logD: | 7.1172 |
logSw: | -6.454 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 40.286 |
InChI Key: | WYJDZWTUDOXKJO-UHFFFAOYSA-N |