N-[2-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-1-benzothiophen-5-yl]-N,4-dimethylbenzene-1-sulfonamide
Chemical Structure Depiction of
N-[2-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-1-benzothiophen-5-yl]-N,4-dimethylbenzene-1-sulfonamide
N-[2-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-1-benzothiophen-5-yl]-N,4-dimethylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | J019-0445 |
| Compound Name: | N-[2-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-1-benzothiophen-5-yl]-N,4-dimethylbenzene-1-sulfonamide |
| Molecular Weight: | 476.62 |
| Molecular Formula: | C26 H24 N2 O3 S2 |
| Smiles: | Cc1ccc(cc1)S(N(C)c1ccc2c(c1)cc(C(N1CCc3ccccc3C1)=O)s2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9969 |
| logD: | 5.9969 |
| logSw: | -5.7772 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.117 |
| InChI Key: | TVZGFENMQRCBFU-UHFFFAOYSA-N |