1-{4-[5-(6,7-dimethoxy-3,4-dihydroisoquinoline-2(1H)-sulfonyl)-2-methoxyphenyl]piperazin-1-yl}-2-phenoxypropan-1-one
Chemical Structure Depiction of
1-{4-[5-(6,7-dimethoxy-3,4-dihydroisoquinoline-2(1H)-sulfonyl)-2-methoxyphenyl]piperazin-1-yl}-2-phenoxypropan-1-one
1-{4-[5-(6,7-dimethoxy-3,4-dihydroisoquinoline-2(1H)-sulfonyl)-2-methoxyphenyl]piperazin-1-yl}-2-phenoxypropan-1-one
Compound characteristics
| Compound ID: | V014-0328 |
| Compound Name: | 1-{4-[5-(6,7-dimethoxy-3,4-dihydroisoquinoline-2(1H)-sulfonyl)-2-methoxyphenyl]piperazin-1-yl}-2-phenoxypropan-1-one |
| Molecular Weight: | 595.72 |
| Molecular Formula: | C31 H37 N3 O7 S |
| Salt: | not_available |
| Smiles: | CC(C(N1CCN(CC1)c1cc(ccc1OC)S(N1CCc2cc(c(cc2C1)OC)OC)(=O)=O)=O)Oc1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2853 |
| logD: | 4.2853 |
| logSw: | -4.3243 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 80.899 |
| InChI Key: | UCJSEVZXIGGANM-QFIPXVFZSA-N |