N-(butan-2-yl)-4-methyl-N-(2-{4-[(2-methylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)benzene-1-sulfonamide
Chemical Structure Depiction of
N-(butan-2-yl)-4-methyl-N-(2-{4-[(2-methylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)benzene-1-sulfonamide
N-(butan-2-yl)-4-methyl-N-(2-{4-[(2-methylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)benzene-1-sulfonamide
Compound characteristics
| Compound ID: | V022-3657 |
| Compound Name: | N-(butan-2-yl)-4-methyl-N-(2-{4-[(2-methylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)benzene-1-sulfonamide |
| Molecular Weight: | 526.72 |
| Molecular Formula: | C28 H34 N2 O4 S2 |
| Smiles: | CCC(C)N(CC(N1CCc2c(ccs2)C1COc1ccccc1C)=O)S(c1ccc(C)cc1)(=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.4557 |
| logD: | 6.4557 |
| logSw: | -5.7561 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 55.904 |
| InChI Key: | RMZDQGSAVZCIJD-UHFFFAOYSA-N |