6,7-dimethoxy-2-{4-methoxy-3-[4-(3-methylbenzene-1-sulfonyl)piperazin-1-yl]benzene-1-sulfonyl}-1,2,3,4-tetrahydroisoquinoline
Chemical Structure Depiction of
6,7-dimethoxy-2-{4-methoxy-3-[4-(3-methylbenzene-1-sulfonyl)piperazin-1-yl]benzene-1-sulfonyl}-1,2,3,4-tetrahydroisoquinoline
6,7-dimethoxy-2-{4-methoxy-3-[4-(3-methylbenzene-1-sulfonyl)piperazin-1-yl]benzene-1-sulfonyl}-1,2,3,4-tetrahydroisoquinoline
Compound characteristics
| Compound ID: | V003-6875 |
| Compound Name: | 6,7-dimethoxy-2-{4-methoxy-3-[4-(3-methylbenzene-1-sulfonyl)piperazin-1-yl]benzene-1-sulfonyl}-1,2,3,4-tetrahydroisoquinoline |
| Molecular Weight: | 601.74 |
| Molecular Formula: | C29 H35 N3 O7 S2 |
| Salt: | not_available |
| Smiles: | Cc1cccc(c1)S(N1CCN(CC1)c1cc(ccc1OC)S(N1CCc2cc(c(cc2C1)OC)OC)(=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5835 |
| logD: | 4.5835 |
| logSw: | -4.4664 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 89.173 |
| InChI Key: | HYFGOOBYEZMVED-UHFFFAOYSA-N |