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Brc1cnc(nc1)C
Pyrimidine, 5-bromo-2-methyl-
CCCP1(=O)OP(=O)(CCC)OP(=O)(O1)CCC
1,3,5,2,4,6-Trioxatriphosphorinane, 2,4,6-tripropyl-, 2,4,6-trioxide
CC1(C)OB(OC1(C)C)B1OC(C(O1)(C)C)(C)C
2,2'-Bi-1,3,2-dioxaborolane, 4,4,4',4',5,5,5',5'-octamethyl-
O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.[Pd].[Pd]
Tris(dibenzylideneacetone)dipalladium
C1CCC(CC1)P(C1CCCCC1)C1CCCCC1.Cc1cc(C)c(c(c1)C)N1CCN(C1=[Ru](=Cc1ccccc1)(Cl)Cl)c1c(C)cc(cc1C)C
Ruthenium,[1,3-bis(2,4,6-trimethylphenyl)-2-imidazolidinylidene]dichloro(phenylmethylene)(tricyclohexylphosphine)-, (SP-5-41)-

4-[[5-(cyclopentyloxycarbonylamino)-1-methylindol-3-yl]methyl]-3-methoxybenzoic acid

COc1cc(ccc1Cc1cn(c2c1cc(cc2)NC(=O)OC1CCCC1)C)C(=O)O Request for Quotation
Chemical Name: 4-[[5-(cyclopentyloxycarbonylamino)-1-methylindol-3-yl]methyl]-3-methoxybenzoic acid
CAS Number: 107754-20-1
Product Number: AG007DU3(AGN-PC-0065X8)
Synonyms:
MDL No:
Molecular Formula: C24H26N2O5
Molecular Weight: 422.4736

Identification/Properties

Computed Properties
Molecular Weight:
422.481g/mol
XLogP3:
4.3
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
7
Exact Mass:
422.184g/mol
Monoisotopic Mass:
422.184g/mol
Topological Polar Surface Area:
89.8A^2
Heavy Atom Count:
31
Formal Charge:
0
Complexity:
638
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information

NMR Spectrum

Other Analytical Data

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Chemical Structure


4-((5-(((Cyclopentyloxy)carbonyl)amino)-1-methyl-1H-indol-3-yl)methyl)-3-methoxybenzoic acid serves as a versatile building block in chemical synthesis by offering a unique combination of functional groups. With its aromatic benzene ring, methoxy group, and carboxylic acid functionality, this compound can participate in various synthetic transformations to yield diversified organic molecules. Its methylindole moiety provides the opportunity for electrostatic interactions and potential π-π stacking with other aromatic moieties, contributing to molecular recognition and binding properties in drug discovery. Furthermore, the presence of the cyclopentyloxy carbonyl amino group enhances solubility and potential bioavailability of the synthesized compounds. This compound can be utilized in the synthesis of novel pharmaceutical agents, agrochemicals, and materials with tailored properties.