{4-[5-(6,7-dimethoxy-3,4-dihydroisoquinoline-2(1H)-sulfonyl)-2-methoxyphenyl]piperazin-1-yl}(3,5-dimethoxyphenyl)methanone
Chemical Structure Depiction of
{4-[5-(6,7-dimethoxy-3,4-dihydroisoquinoline-2(1H)-sulfonyl)-2-methoxyphenyl]piperazin-1-yl}(3,5-dimethoxyphenyl)methanone
{4-[5-(6,7-dimethoxy-3,4-dihydroisoquinoline-2(1H)-sulfonyl)-2-methoxyphenyl]piperazin-1-yl}(3,5-dimethoxyphenyl)methanone
Compound characteristics
| Compound ID: | V010-6868 |
| Compound Name: | {4-[5-(6,7-dimethoxy-3,4-dihydroisoquinoline-2(1H)-sulfonyl)-2-methoxyphenyl]piperazin-1-yl}(3,5-dimethoxyphenyl)methanone |
| Molecular Weight: | 611.71 |
| Molecular Formula: | C31 H37 N3 O8 S |
| Salt: | not_available |
| Smiles: | COc1cc(cc(c1)OC)C(N1CCN(CC1)c1cc(ccc1OC)S(N1CCc2cc(c(cc2C1)OC)OC)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.087 |
| logD: | 4.087 |
| logSw: | -4.3 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 89.198 |
| InChI Key: | ZENMWJYHMHXFGJ-UHFFFAOYSA-N |