N-[2-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-1-benzothiophen-5-yl]-4-methoxy-N-methylbenzene-1-sulfonamide
Chemical Structure Depiction of
N-[2-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-1-benzothiophen-5-yl]-4-methoxy-N-methylbenzene-1-sulfonamide
N-[2-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-1-benzothiophen-5-yl]-4-methoxy-N-methylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | J019-0590 |
| Compound Name: | N-[2-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-1-benzothiophen-5-yl]-4-methoxy-N-methylbenzene-1-sulfonamide |
| Molecular Weight: | 492.62 |
| Molecular Formula: | C26 H24 N2 O4 S2 |
| Smiles: | CN(c1ccc2c(c1)cc(C(N1CCc3ccccc3C1)=O)s2)S(c1ccc(cc1)OC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5559 |
| logD: | 5.5559 |
| logSw: | -5.6848 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.66 |
| InChI Key: | HEPGUJFXHOULFQ-UHFFFAOYSA-N |