Name: Name:1-(4-Methoxyphenyl)-5-phenyl-1h-pyrazole-3-carboxylic acid
Brand: Angene
SKU: AG00EDYP
Rating: 90 (10 reviews)

1-(4-Methoxyphenyl)-5-phenyl-1h-pyrazole-3-carboxylic acid

CAS No.:

62160-80-9

Catalog Number:

AG00EDYP

Molecular Formula:

C17H14N2O3

Molecular Weight:

294.3047

Pack Size

Purity

Availability

Location

Price(USD)

Quantity

95%

In Stock USA

United States

$96

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Product Description

Catalog Number:

AG00EDYP

Chemical Name:

1-(4-Methoxyphenyl)-5-phenyl-1h-pyrazole-3-carboxylic acid

CAS Number:

62160-80-9

Molecular Formula:

C17H14N2O3

Molecular Weight:

294.3047

MDL Number:

MFCD01427275

IUPAC Name:

1-(4-methoxyphenyl)-5-phenylpyrazole-3-carboxylic acid

InChI:

InChI=1S/C17H14N2O3/c1-22-14-9-7-13(8-10-14)19-16(11-15(18-19)17(20)21)12-5-3-2-4-6-12/h2-11H,1H3,(H,20,21)

InChI Key:

JTDIEDQRYAXLPI-UHFFFAOYSA-N

SMILES:

COc1ccc(cc1)n1nc(cc1c1ccccc1)C(=O)O

Properties

Complexity:

376

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

294.1g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

294.31g/mol

Monoisotopic Mass:

294.1g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

64.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.4

Literature

Title	Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.	Bioorganic & medicinal chemistry letters 20101101
Microsphere-based protease assays and screening application for lethal factor and factor Xa.	Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

Properties