Name: Name:5-methyl-1-(quinolin-5-yl)-1H-1,2,3-triazole-4-carboxylic acid
Brand: Angene
SKU: AG01AGXL
Rating: 90 (10 reviews)

5-methyl-1-(quinolin-5-yl)-1H-1,2,3-triazole-4-carboxylic acid

CAS No.:

1049129-19-2

Catalog Number:

AG01AGXL

Molecular Formula:

C13H10N4O2

Molecular Weight:

254.2441

Catalog Number:

AG01AGXL

Chemical Name:

5-methyl-1-(quinolin-5-yl)-1H-1,2,3-triazole-4-carboxylic acid

CAS Number:

1049129-19-2

Molecular Formula:

C13H10N4O2

Molecular Weight:

254.2441

MDL Number:

MFCD11559160

IUPAC Name:

5-methyl-1-quinolin-5-yltriazole-4-carboxylic acid

InChI:

InChI=1S/C13H10N4O2/c1-8-12(13(18)19)15-16-17(8)11-6-2-5-10-9(11)4-3-7-14-10/h2-7H,1H3,(H,18,19)

InChI Key:

NNNPILZCTONAAQ-UHFFFAOYSA-N

SMILES:

OC(=O)c1nnn(c1C)c1cccc2c1cccn2

Complexity:

352

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

254.08g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

254.249g/mol

Monoisotopic Mass:

254.08g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

80.9A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.9