Name: Name:4-(4-Fluorophenyl)-6-isopropyl-2-(n-methyl-n-methylsulfonylamino)pyrimidine-5-carboxaldehyde
Brand: AABLOCKS
SKU: AA001EK9
Rating: 90 (10 reviews)

Catalog No.: AA001EK9

147118-37-4 | 4-(4-Fluorophenyl)-6-isopropyl-2-(n-methyl-n-methylsulfonylamino)pyrimidine-5-carboxaldehyde

Pack Size： 5g

Purity： 97%

in stock

$28.00 $19.00

Pack Size： 10g

Purity： 97%

in stock

$47.00 $33.00

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Technical Information

Catalog Number: AA001EK9

Chemical Name: 4-(4-Fluorophenyl)-6-isopropyl-2-(n-methyl-n-methylsulfonylamino)pyrimidine-5-carboxaldehyde

CAS Number: 147118-37-4

Molecular Formula: C16H18FN3O3S

Molecular Weight: 351.3958

MDL Number: MFCD08458342

SMILES: O=Cc1c(nc(nc1C(C)C)N(S(=O)(=O)C)C)c1ccc(cc1)F

Properties

BP: 536.594°C at 760 mmHg

Form: Solid

MP: 178.0 to 182.0 °C

Storage: Inert atmosphere;2-8℃;

Complexity: 529

Covalently-Bonded Unit Count: 1

Defined Atom Stereocenter Count: 0

Defined Bond Stereocenter Count: 0

Formal Charge: 0

Heavy Atom Count: 24

Hydrogen Bond Acceptor Count: 7

Hydrogen Bond Donor Count: 0

Isotope Atom Count: 0

Rotatable Bond Count: 5

Undefined Atom Stereocenter Count: 0

Undefined Bond Stereocenter Count: 0

XLogP3: 2.1

Upstream Synthesis Route

147118-35-2

147118-37-4

147118-39-6

[1]Patent:WO2011/141934,2011,A1,.Locationinpatent:Page/Pagecolumn17;18-19

147118-37-4

147118-39-6

[1]BioorganicandMedicinalChemistry,1997,vol.5,#2,p.437-444

[2]Patent:EP2298745,2011,A1,

[3]Patent:WO2012/63115,2012,A2,

[4]Patent:CN104844525,2017,B,

[5]Patent:CN108586358,2018,A,

147118-37-4

289042-10-0

[1]OrganicLetters,2018,vol.20,#11,p.3286-3290

147118-37-4

799842-07-2

[1]OrganicLetters,2018,vol.20,#11,p.3286-3290

380460-37-7

147118-37-4

289042-12-2

[1]Patent:CN107298675,2017,A,.Locationinpatent:Paragraph0023-0026;0027-0030;0031-0034

[2]Patent:WO2016/125086,2016,A1,.Locationinpatent:Page/Pagecolumn26-27

Downstream Synthesis Route

2537-48-6

147118-37-4

890028-65-6

[1]Patent:US2008/91014,2008,A1.Locationinpatent:Page/Pagecolumn4

459-57-4

PhCH2CH2MgHal

147118-37-4

[1]BioorganicandMedicinalChemistry,1997,vol.5,p.437-444

122930-45-4

147118-37-4

[1]BioorganicandMedicinalChemistry,1997,vol.5,p.437-444

7152-15-0

147118-37-4

[1]BioorganicandMedicinalChemistry,1997,vol.5,p.437-444

147118-32-9

147118-37-4

[1]BioorganicandMedicinalChemistry,1997,vol.5,p.437-444

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