N-(butan-2-yl)-3-methyl-N-(2-{4-[(2-methylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)butanamide
Chemical Structure Depiction of
N-(butan-2-yl)-3-methyl-N-(2-{4-[(2-methylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)butanamide
N-(butan-2-yl)-3-methyl-N-(2-{4-[(2-methylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)butanamide
Compound characteristics
| Compound ID: | V022-3632 |
| Compound Name: | N-(butan-2-yl)-3-methyl-N-(2-{4-[(2-methylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)butanamide |
| Molecular Weight: | 456.65 |
| Molecular Formula: | C26 H36 N2 O3 S |
| Smiles: | CCC(C)N(CC(N1CCc2c(ccs2)C1COc1ccccc1C)=O)C(CC(C)C)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.8707 |
| logD: | 5.8707 |
| logSw: | -5.5322 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 39.445 |
| InChI Key: | SKIJPJDWQGTHBR-UHFFFAOYSA-N |