Name: Name:(2E)-3-(1,3-diphenyl-1H-pyrazol-4-yl)prop-2-enoic acid
Brand: Angene
SKU: AG01EM85
Rating: 90 (10 reviews)

(2E)-3-(1,3-diphenyl-1H-pyrazol-4-yl)prop-2-enoic acid

CAS No.:

519137-38-3

Catalog Number:

AG01EM85

Molecular Formula:

C18H14N2O2

Molecular Weight:

290.3160

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Product Description

Catalog Number:

AG01EM85

Chemical Name:

(2E)-3-(1,3-diphenyl-1H-pyrazol-4-yl)prop-2-enoic acid

CAS Number:

519137-38-3

Molecular Formula:

C18H14N2O2

Molecular Weight:

290.3160

MDL Number:

MFCD01957221

IUPAC Name:

(E)-3-(1,3-diphenylpyrazol-4-yl)prop-2-enoic acid

InChI:

InChI=1S/C18H14N2O2/c21-17(22)12-11-15-13-20(16-9-5-2-6-10-16)19-18(15)14-7-3-1-4-8-14/h1-13H,(H,21,22)/b12-11+

InChI Key:

QWPUNBPIUCTWSD-VAWYXSNFSA-N

SMILES:

OC(=O)/C=C/c1cn(nc1c1ccccc1)c1ccccc1

Properties

Complexity:

398

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

290.106g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

290.322g/mol

Monoisotopic Mass:

290.106g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.5

Literature

Title	Journal
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

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