4-bromo-N-cyclohexyl-N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]benzene-1-sulfonamide
Chemical Structure Depiction of
4-bromo-N-cyclohexyl-N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]benzene-1-sulfonamide
4-bromo-N-cyclohexyl-N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]benzene-1-sulfonamide
Compound characteristics
| Compound ID: | 5072-2130 |
| Compound Name: | 4-bromo-N-cyclohexyl-N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]benzene-1-sulfonamide |
| Molecular Weight: | 491.45 |
| Molecular Formula: | C23 H27 Br N2 O3 S |
| Smiles: | C1CCC(CC1)N(CC(N1CCc2ccccc2C1)=O)S(c1ccc(cc1)[Br])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.168 |
| logD: | 5.168 |
| logSw: | -5.149 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 47.68 |
| InChI Key: | MJRQRYSGGOMUQJ-UHFFFAOYSA-N |