4-chloro-N-(2-{4-[(2-fluorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-[(oxolan-2-yl)methyl]benzene-1-sulfonamide
Chemical Structure Depiction of
4-chloro-N-(2-{4-[(2-fluorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-[(oxolan-2-yl)methyl]benzene-1-sulfonamide
4-chloro-N-(2-{4-[(2-fluorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-[(oxolan-2-yl)methyl]benzene-1-sulfonamide
Compound characteristics
| Compound ID: | V009-2205 |
| Compound Name: | 4-chloro-N-(2-{4-[(2-fluorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-[(oxolan-2-yl)methyl]benzene-1-sulfonamide |
| Molecular Weight: | 579.11 |
| Molecular Formula: | C27 H28 Cl F N2 O5 S2 |
| Smiles: | C1CC(CN(CC(N2CCc3c(ccs3)C2COc2ccccc2F)=O)S(c2ccc(cc2)[Cl])(=O)=O)OC1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.0927 |
| logD: | 5.0927 |
| logSw: | -5.4656 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 63.92 |
| InChI Key: | DAGUDUFCNKUFMX-UHFFFAOYSA-N |