{4-[5-(6,7-dimethoxy-3,4-dihydroisoquinoline-2(1H)-sulfonyl)-2-methoxyphenyl]piperazin-1-yl}(3,4,5-trimethoxyphenyl)methanone
Chemical Structure Depiction of
{4-[5-(6,7-dimethoxy-3,4-dihydroisoquinoline-2(1H)-sulfonyl)-2-methoxyphenyl]piperazin-1-yl}(3,4,5-trimethoxyphenyl)methanone
{4-[5-(6,7-dimethoxy-3,4-dihydroisoquinoline-2(1H)-sulfonyl)-2-methoxyphenyl]piperazin-1-yl}(3,4,5-trimethoxyphenyl)methanone
Compound characteristics
| Compound ID: | V017-8692 |
| Compound Name: | {4-[5-(6,7-dimethoxy-3,4-dihydroisoquinoline-2(1H)-sulfonyl)-2-methoxyphenyl]piperazin-1-yl}(3,4,5-trimethoxyphenyl)methanone |
| Molecular Weight: | 641.74 |
| Molecular Formula: | C32 H39 N3 O9 S |
| Salt: | not_available |
| Smiles: | COc1ccc(cc1N1CCN(CC1)C(c1cc(c(c(c1)OC)OC)OC)=O)S(N1CCc2cc(c(cc2C1)OC)OC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6023 |
| logD: | 3.6023 |
| logSw: | -3.9013 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 97.088 |
| InChI Key: | JXRYITNSKDUUFA-UHFFFAOYSA-N |