6-(3,6-Dihydro-1,1-dioxido-2H-thiopyran-4-yl)-5-[4-[2-(1-piperidinyl)ethoxy]phenoxy]-2-naphthalenol

Base Information

Chemical Name:6-(3,6-Dihydro-1,1-dioxido-2H-thiopyran-4-yl)-5-[4-[2-(1-piperidinyl)ethoxy]phenoxy]-2-naphthalenol
CAS No.:862129-85-9
Molecular Formula:C₂₈H₃₁NO₅S
Molecular Weight:493.624
Hs Code.:
ChEMBL ID:CHEMBL244207
DSSTox Substance ID:DTXSID001114642
Pharos Ligand ID:K4CKFPXPZKXG

Synonyms:CHEMBL244207;SCHEMBL3844030;PRSCKUYRGQJIGJ-UHFFFAOYSA-N;DTXSID001114642;BDBM50212152;6-(3,6-Dihydro-1,1-dioxido-2H-thiopyran-4-yl)-5-[4-[2-(1-piperidinyl)ethoxy]phenoxy]-2-naphthalenol;862129-85-9;6-(1,1-dioxo-1,2,3,6-tetrahydro-1lambda*6*-thiopyran-4-yl)-5-[4-(2-piperidin-1-yl-ethoxy)-phenoxy]-naphthalen-2-ol;6-(1,1-Dioxo-1,2,3,6-tetrahydro-1lambda6-thiopyran-4-yl)-5-[4-(2-piperidin-1-yl-ethoxy)-phenoxy]-naphthalen-2-ol

Suppliers and Price of 6-(3,6-Dihydro-1,1-dioxido-2H-thiopyran-4-yl)-5-[4-[2-(1-piperidinyl)ethoxy]phenoxy]-2-naphthalenol

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of 6-(3,6-Dihydro-1,1-dioxido-2H-thiopyran-4-yl)-5-[4-[2-(1-piperidinyl)ethoxy]phenoxy]-2-naphthalenol

Chemical Property:

XLogP3:4.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:7
Exact Mass:493.19229426
Heavy Atom Count:35
Complexity:810

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1CCN(CC1)CCOC2=CC=C(C=C2)OC3=C(C=CC4=C3C=CC(=C4)O)C5=CCS(=O)(=O)CC5

Technology Process of 6-(3,6-Dihydro-1,1-dioxido-2H-thiopyran-4-yl)-5-[4-[2-(1-piperidinyl)ethoxy]phenoxy]-2-naphthalenol

There total 13 articles about 6-(3,6-Dihydro-1,1-dioxido-2H-thiopyran-4-yl)-5-[4-[2-(1-piperidinyl)ethoxy]phenoxy]-2-naphthalenol which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 82.0%

: 1-(2-{4-[2-(1,1-dioxo-1,2,3,6-tetrahydro-1λ6-thiopyran-4-yl)-6-methoxy-naphthalen-1-yloxy]-phenoxy}-ethyl)-piperidine hydrochloride

: 862129-85-9
6-(1,1-dioxo-1,2,3,6-tetrahydro-1λ6-thiopyran-4-yl)-5-[4-(2-piperidin-1-yl-ethoxy)-phenoxy]-naphthalen-2-ol

Guidance literature:: With boron tribromide; In dichloromethane; 2-Methyl-1-butene; at 0 ℃; for 0.5h;

Reference yield:

: 648904-47-6
2-(benzyloxy)-1-bromo-6-methoxynaphthalene

: 862129-85-9
6-(1,1-dioxo-1,2,3,6-tetrahydro-1λ6-thiopyran-4-yl)-5-[4-(2-piperidin-1-yl-ethoxy)-phenoxy]-naphthalen-2-ol

Guidance literature:: Multi-step reaction with 6 steps

1: 30 percent / copper triflate

2: NH₄HCO₂ / Pd(OH)2

3: PCy₃; CsF / Pd(OAc)2

4: oxone / methanol

5: BBr₃; isobutene / CH₂Cl₂

With Oxone; ammonium formate; boron tribromide; copper(I) triflate; cesium fluoride; isobutene; tricyclohexylphosphine; palladium diacetate; palladium dihydroxide; In methanol; dichloromethane; 1: Ullman coupling / 4: Suzuki coupling;
DOI:10.1016/j.bmcl.2007.04.044

Reference yield:

: 648904-49-8
6-methoxy-1-[4-(2-piperidin-1-ylethoxy)phenoxy]naphthalene-2-ol

: 862129-85-9
6-(1,1-dioxo-1,2,3,6-tetrahydro-1λ6-thiopyran-4-yl)-5-[4-(2-piperidin-1-yl-ethoxy)-phenoxy]-naphthalen-2-ol

Guidance literature:: Multi-step reaction with 4 steps

1: PCy₃; CsF / Pd(OAc)2

2: oxone / methanol

3: BBr₃; isobutene / CH₂Cl₂

With Oxone; boron tribromide; cesium fluoride; isobutene; tricyclohexylphosphine; palladium diacetate; In methanol; dichloromethane; 2: Suzuki coupling;
DOI:10.1016/j.bmcl.2007.04.044