Name: Name:Benzoic acid, 2-[[(2E)-3-[3-methoxy-4-(2-propyn-1-yloxy)phenyl]-1-oxo-2-propen-1-yl]amino]-
Brand: Angene
SKU: AG000112
Rating: 90 (10 reviews)

Benzoic acid, 2-[[(2E)-3-[3-methoxy-4-(2-propyn-1-yloxy)phenyl]-1-oxo-2-propen-1-yl]amino]-

CAS No.:

1001288-58-9

Catalog Number:

AG000112

Molecular Formula:

C20H17NO5

Molecular Weight:

351.3527

Pack Size

Purity

Availability

Location

Price(USD)

Quantity

2mg

99%

1 week

United States

$223

- +

5mg

99%

1 week

United States

$307

- +

10mg

99%

1 week

United States

$457

- +

50mg

99%

1 week

United States

$1573

- +

100mg

99%

1 week

United States

$2723

- +

Product Description

Catalog Number:

AG000112

Chemical Name:

Benzoic acid, 2-[[(2E)-3-[3-methoxy-4-(2-propyn-1-yloxy)phenyl]-1-oxo-2-propen-1-yl]amino]-

CAS Number:

1001288-58-9

Molecular Formula:

C20H17NO5

Molecular Weight:

351.3527

MDL Number:

MFCD28502026

IUPAC Name:

2-[[(E)-3-(3-methoxy-4-prop-2-ynoxyphenyl)prop-2-enoyl]amino]benzoic acid

InChI:

InChI=1S/C20H17NO5/c1-3-12-26-17-10-8-14(13-18(17)25-2)9-11-19(22)21-16-7-5-4-6-15(16)20(23)24/h1,4-11,13H,12H2,2H3,(H,21,22)(H,23,24)/b11-9+

InChI Key:

UIWZIDIJCUEOMT-PKNBQFBNSA-N

SMILES:

C#CCOc1ccc(cc1OC)/C=C/C(=O)Nc1ccccc1C(=O)O

Properties

Complexity:

564

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

351.111g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

351.358g/mol

Monoisotopic Mass:

351.111g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

84.9A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.3

Literature

Title	Journal
FT011, a new anti-fibrotic drug, attenuates fibrosis and chronic heart failure in experimental diabetic cardiomyopathy.	European journal of heart failure 20120501
Evaluation and optimization of antifibrotic activity of cinnamoyl anthranilates.	Bioorganic & medicinal chemistry letters 20091215