Name: Name:3-[5,7-dimethyl-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]propanoic acid
Brand: Angene
SKU: AG019OSP
Rating: 90 (10 reviews)

3-[5,7-dimethyl-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]propanoic acid

CAS No.:

885525-04-2

Catalog Number:

AG019OSP

Molecular Formula:

C11H11F3N4O2

Molecular Weight:

288.2258

Catalog Number:

AG019OSP

Chemical Name:

3-[5,7-dimethyl-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]propanoic acid

CAS Number:

885525-04-2

Molecular Formula:

C11H11F3N4O2

Molecular Weight:

288.2258

MDL Number:

MFCD07685902

IUPAC Name:

3-[5,7-dimethyl-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]propanoic acid

InChI:

InChI=1S/C11H11F3N4O2/c1-5-7(3-4-8(19)20)6(2)18-10(15-5)16-9(17-18)11(12,13)14/h3-4H2,1-2H3,(H,19,20)

InChI Key:

RXGDIZGVBPYXKR-UHFFFAOYSA-N

SMILES:

OC(=O)CCc1c(C)nc2n(c1C)nc(n2)C(F)(F)F

Complexity:

379

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

288.083g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

288.23g/mol

Monoisotopic Mass:

288.083g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

80.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.6