Catalog No.:AA01DU6X

885066-67-1 | Benzeneacetic acid,3-[6-[[2-(2,4-dichlorophenyl)ethyl]amino]-2-methoxy-4-pyrimidinyl]-a,a-dimethyl-

Name: Name:Benzeneacetic acid,3-[6-[[2-(2,4-dichlorophenyl)ethyl]amino]-2-methoxy-4-pyrimidinyl]-a,a-dimethyl-
Brand: AABLOCKS
SKU: AA01DU6X
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1mg

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5mg

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$445.00 $312.00

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10mg

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$659.00 $462.00

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50mg

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$1,666.00 $1,167.00

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100mg

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Technical Information
Properties
Downstream Synthesis Route
Literature
Request for Quotation
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Technical Information
Properties
Downstream Synthesis Route
Literature

Technical Information

Catalog Number:

AA01DU6X

Chemical Name:

Benzeneacetic acid,3-[6-[[2-(2,4-dichlorophenyl)ethyl]amino]-2-methoxy-4-pyrimidinyl]-a,a-dimethyl-

CAS Number:

885066-67-1

Molecular Formula:

C23H23Cl2N3O3

Molecular Weight:

460.3530

MDL Number:

MFCD30721575

SMILES:

COc1nc(NCCc2ccc(cc2Cl)Cl)cc(n1)c1cccc(c1)C(C(=O)O)(C)C

Properties

Computed Properties

Complexity:

594

Covalently-Bonded Unit Count:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Rotatable Bond Count:

XLogP3:

6.1

Downstream Synthesis Route

885066-67-1

34813-49-5

2-methylpropane-2-sulfonicacid(2-(3-(6-(2-(2,4-dichlorophenyl)ethylamino)-2-methoxypyrimidin-4-yl)phenyl)-2-methylpropionyl)amide

[1]Patent:WO2007/121280,2007,A1.Locationinpatent:Page/Pagecolumn33

885066-67-1

1520-70-3

ethanesulfonicacid2-(3-{6-2-(2,4-dichloro-phenyl)-ethylamino-2-methoxy-pyrimidin-4-yl}-phenyl)-2-methyl-propionyl-amide

[1]Patent:WO2006/44732,2006,A2.Locationinpatent:Page/Pagecolumn223-224

885066-67-1

50893-36-2

2-(3-{6-2-(2,4-dichloro-phenyl)-ethylamino-2-methoxy-pyrimidin-4-yl}-phenyl)-2-methyl-propionicacid1-ethoxycarbonyloxy-ethylester

[1]Patent:WO2006/44732,2006,A2.Locationinpatent:Page/Pagecolumn174

[2]Patent:WO2008/39882,2008,A1.Locationinpatent:Page/Pagecolumn173-174

81606-47-5

885066-67-1

[1]Patent:WO2007/121280,2007,A1

1074-40-4

885066-67-1

[1]Patent:WO2007/121280,2007,A1

Literature

Title: Lim, Sungtaek, et al. 2, 6-SUBSTITUTED-4-MONOSUBSTITUTEDAMINO-PYRIMIDINE AS PROSTAGLANDIN D2 RECEPTOR ANTAGONISTS. WO2006044732A2.

Title: Mu L, et al. Understanding DP receptor antagonism using a CoMSIA approach. Bioorg Med Chem Lett. 2011 Jan 1;21(1):66-75.

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SDS