N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-3-fluoro-4-methyl-N-(oxan-4-yl)benzene-1-sulfonamide
Chemical Structure Depiction of
N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-3-fluoro-4-methyl-N-(oxan-4-yl)benzene-1-sulfonamide
N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-3-fluoro-4-methyl-N-(oxan-4-yl)benzene-1-sulfonamide
Compound characteristics
| Compound ID: | SC12-0040 |
| Compound Name: | N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-3-fluoro-4-methyl-N-(oxan-4-yl)benzene-1-sulfonamide |
| Molecular Weight: | 446.58 |
| Molecular Formula: | C24 H31 F N2 O3 S |
| Smiles: | Cc1ccc(cc1F)S(N(CCCN1CCc2ccccc2C1)C1CCOCC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3509 |
| logD: | 3.9058 |
| logSw: | -4.159 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 43.157 |
| InChI Key: | LBHBDUBBLKLTFV-UHFFFAOYSA-N |