2-{3-[4-(4-butylbenzene-1-sulfonyl)piperazin-1-yl]-4-methoxybenzene-1-sulfonyl}-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline
Chemical Structure Depiction of
2-{3-[4-(4-butylbenzene-1-sulfonyl)piperazin-1-yl]-4-methoxybenzene-1-sulfonyl}-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline
2-{3-[4-(4-butylbenzene-1-sulfonyl)piperazin-1-yl]-4-methoxybenzene-1-sulfonyl}-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline
Compound characteristics
| Compound ID: | V006-7600 |
| Compound Name: | 2-{3-[4-(4-butylbenzene-1-sulfonyl)piperazin-1-yl]-4-methoxybenzene-1-sulfonyl}-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline |
| Molecular Weight: | 643.82 |
| Molecular Formula: | C32 H41 N3 O7 S2 |
| Salt: | not_available |
| Smiles: | CCCCc1ccc(cc1)S(N1CCN(CC1)c1cc(ccc1OC)S(N1CCc2cc(c(cc2C1)OC)OC)(=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.128 |
| logD: | 6.128 |
| logSw: | -5.516 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 89.173 |
| InChI Key: | UZTYOXOGCNZCMS-UHFFFAOYSA-N |