4-chloro-N-(2-{4-[(4-fluorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-(2-methylbutyl)benzene-1-sulfonamide
Chemical Structure Depiction of
4-chloro-N-(2-{4-[(4-fluorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-(2-methylbutyl)benzene-1-sulfonamide
4-chloro-N-(2-{4-[(4-fluorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-(2-methylbutyl)benzene-1-sulfonamide
Compound characteristics
| Compound ID: | V002-3128 |
| Compound Name: | 4-chloro-N-(2-{4-[(4-fluorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-(2-methylbutyl)benzene-1-sulfonamide |
| Molecular Weight: | 565.13 |
| Molecular Formula: | C27 H30 Cl F N2 O4 S2 |
| Smiles: | CCC(C)CN(CC(N1CCc2c(ccs2)C1COc1ccc(cc1)F)=O)S(c1ccc(cc1)[Cl])(=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.6231 |
| logD: | 6.6231 |
| logSw: | -6.3074 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 55.451 |
| InChI Key: | MVKHLXGJHIHBAD-UHFFFAOYSA-N |