Name: Name:N-[3-(3-{4-[(dimethylamino)methyl]phenyl}pyrazolo[1,5-a]pyrimidin-7-yl)phenyl]-3-(trifluoromethyl)benzamide
Brand: Angene
SKU: AG00IIPW
Rating: 90 (10 reviews)

N-[3-(3-{4-[(dimethylamino)methyl]phenyl}pyrazolo[1,5-a]pyrimidin-7-yl)phenyl]-3-(trifluoromethyl)benzamide

CAS No.:

950736-05-7

Catalog Number:

AG00IIPW

Molecular Formula:

C29H24F3N5O

Molecular Weight:

515.5290

Pack Size

Purity

Availability

Location

Price(USD)

Quantity

1mg

≥98%

1 week

United States

$125

- +

5mg

≥98%

1 week

United States

$364

- +

10mg

≥98%

1 week

United States

$601

- +

25mg

≥98%

1 week

United States

$1162

- +

50mg

98%

1 week

United States

$1640

- +

100mg

98%

1 week

United States

$2557

- +

Product Description

Catalog Number:

AG00IIPW

Chemical Name:

N-[3-(3-{4-[(dimethylamino)methyl]phenyl}pyrazolo[1,5-a]pyrimidin-7-yl)phenyl]-3-(trifluoromethyl)benzamide

CAS Number:

950736-05-7

Molecular Formula:

C29H24F3N5O

Molecular Weight:

515.5290

MDL Number:

MFCD25977055

IUPAC Name:

N-[3-[3-[4-[(dimethylamino)methyl]phenyl]pyrazolo[1,5-a]pyrimidin-7-yl]phenyl]-3-(trifluoromethyl)benzamide

InChI:

InChI=1S/C29H24F3N5O/c1-36(2)18-19-9-11-20(12-10-19)25-17-34-37-26(13-14-33-27(25)37)21-5-4-8-24(16-21)35-28(38)22-6-3-7-23(15-22)29(30,31)32/h3-17H,18H2,1-2H3,(H,35,38)

InChI Key:

AIWJVLQNYNCDSL-UHFFFAOYSA-N

SMILES:

CN(Cc1ccc(cc1)c1cnn2c1nccc2c1cccc(c1)NC(=O)c1cccc(c1)C(F)(F)F)C

Properties

Complexity:

787

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

515.193g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

515.54g/mol

Monoisotopic Mass:

515.193g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

62.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

5.2

Literature

Title	Journal
Non-hinge-binding pyrazolo[1,5-a]pyrimidines as potent B-Raf kinase inhibitors.	Bioorganic & medicinal chemistry letters 20091201
Specific ion-exchange chromatography and fluorimetric assay for urinary 3-O-methyldopamine.	Journal of chromatography 19760121