4-chloro-N-[2-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-1-benzothiophen-5-yl]-N-methylbenzene-1-sulfonamide
Chemical Structure Depiction of
4-chloro-N-[2-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-1-benzothiophen-5-yl]-N-methylbenzene-1-sulfonamide
4-chloro-N-[2-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-1-benzothiophen-5-yl]-N-methylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | J019-0505 |
| Compound Name: | 4-chloro-N-[2-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-1-benzothiophen-5-yl]-N-methylbenzene-1-sulfonamide |
| Molecular Weight: | 497.03 |
| Molecular Formula: | C25 H21 Cl N2 O3 S2 |
| Smiles: | CN(c1ccc2c(c1)cc(C(N1CCc3ccccc3C1)=O)s2)S(c1ccc(cc1)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.1682 |
| logD: | 6.1682 |
| logSw: | -6.1132 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.117 |
| InChI Key: | WNVRNIQZDPNRHV-UHFFFAOYSA-N |