Name: Name:5-Chloro-1-methyl-1h-indole-2-carboxylic acid
Brand: AABLOCKS
SKU: AA00EAR3
Rating: 90 (10 reviews)

Catalog No.: AA00EAR3

59908-47-3 | 5-Chloro-1-methyl-1h-indole-2-carboxylic acid

Pack Size： 250mg

Purity： 98%

in stock

$34.00 $24.00

Pack Size： 1g

Purity： 98%

in stock

$89.00 $62.00

Pack Size： 5g

Purity： 98%

in stock

$440.00 $308.00

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Technical Information

Catalog Number: AA00EAR3

Chemical Name: 5-Chloro-1-methyl-1h-indole-2-carboxylic acid

CAS Number: 59908-47-3

Molecular Formula: C10H8ClNO2

Molecular Weight: 209.6290

MDL Number: MFCD03848205

SMILES: Clc1ccc2c(c1)cc(n2C)C(=O)O

Properties

Complexity: 246

Covalently-Bonded Unit Count: 1

Defined Atom Stereocenter Count: 0

Defined Bond Stereocenter Count: 0

Formal Charge: 0

Heavy Atom Count: 14

Hydrogen Bond Acceptor Count: 2

Hydrogen Bond Donor Count: 1

Isotope Atom Count: 0

Rotatable Bond Count: 1

Undefined Atom Stereocenter Count: 0

Undefined Bond Stereocenter Count: 0

XLogP3: 2.6

Upstream Synthesis Route

148356-79-0

59908-47-3

[1]Patent:KR101725451,2017,B1,.Locationinpatent:Paragraph0294;0301-0303

[2]Patent:WO2016/40449,2016,A1,.Locationinpatent:Paragraph00508-00509

[3]Patent:WO2006/66879,2006,A2,.Locationinpatent:Page/Pagecolumn53;48

[4]BioorganicandMedicinalChemistry,2018,vol.26,#21,p.5664-5671

4792-67-0

74-88-4

59908-47-3

59908-53-1

[1]BioorganicandMedicinalChemistryLetters,2017,vol.27,#20,p.4770-4776

10517-21-2

74-88-4

59908-47-3

[1]Patent:WO2006/66879,2006,A2,.Locationinpatent:Page/Pagecolumn48-49;53

10517-21-2

59908-47-3

[1]Patent:WO2016/40449,2016,A1,

[2]BioorganicandMedicinalChemistry,2018,vol.26,#21,p.5664-5671

87802-11-7

59908-47-3

[1]Patent:KR101725451,2017,B1,

Downstream Synthesis Route

59908-47-3

3-{4-3-(aminomethyl)phenoxy-2-methylphenyl}propanoicacidester

3-4-(3-(5-chloro-1-methyl-1H-indole-2-carbonyl)-amino-methyl}-phenoxy)-2-methyl-phenyl-propionicacid

[1]BioorganicandMedicinalChemistryLetters,2007,vol.17,p.6744-6749

10517-21-2

74-88-4

59908-47-3

[1]Patent:WO2006/66879,2006,A2.Locationinpatent:Page/Pagecolumn48-49;53

148356-79-0

59908-47-3

[1]Patent:KR101725451,2017,B1.Locationinpatent:Paragraph0294;0301-0303

[2]Patent:WO2016/40449,2016,A1.Locationinpatent:Paragraph00508-00509

[3]Patent:WO2006/66879,2006,A2.Locationinpatent:Page/Pagecolumn53;48

[4]BioorganicandMedicinalChemistry,2018,vol.26,p.5664-5671

Literature fold

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters20101101

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