Name: Name:(2E)-3-[3-(4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enoic acid
Brand: Angene
SKU: AG01EM3O
Rating: 90 (10 reviews)

(2E)-3-[3-(4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enoic acid

CAS No.:

519137-43-0

Catalog Number:

AG01EM3O

Molecular Formula:

C19H16N2O3

Molecular Weight:

320.3419

Catalog Number:

AG01EM3O

Chemical Name:

(2E)-3-[3-(4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enoic acid

CAS Number:

519137-43-0

Molecular Formula:

C19H16N2O3

Molecular Weight:

320.3419

IUPAC Name:

(E)-3-[3-(4-methoxyphenyl)-1-phenylpyrazol-4-yl]prop-2-enoic acid

InChI:

InChI=1S/C19H16N2O3/c1-24-17-10-7-14(8-11-17)19-15(9-12-18(22)23)13-21(20-19)16-5-3-2-4-6-16/h2-13H,1H3,(H,22,23)/b12-9+

InChI Key:

QQLAJYFBOAHMSU-FMIVXFBMSA-N

SMILES:

COc1ccc(cc1)c1nn(cc1/C=C/C(=O)O)c1ccccc1

Complexity:

440

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

320.116g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

320.348g/mol

Monoisotopic Mass:

320.116g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

64.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.5