Name: Name:4-methyl-2-(1-methyl-1H-pyrazol-4-yl)-1,3-thiazole-5-carboxylic acid
Brand: Angene
SKU: AG01AIN4
Rating: 90 (10 reviews)

4-methyl-2-(1-methyl-1H-pyrazol-4-yl)-1,3-thiazole-5-carboxylic acid

CAS No.:

1152599-54-6

Catalog Number:

AG01AIN4

Molecular Formula:

C9H9N3O2S

Molecular Weight:

223.2517

Catalog Number:

AG01AIN4

Chemical Name:

4-methyl-2-(1-methyl-1H-pyrazol-4-yl)-1,3-thiazole-5-carboxylic acid

CAS Number:

1152599-54-6

Molecular Formula:

C9H9N3O2S

Molecular Weight:

223.2517

MDL Number:

MFCD11207801

IUPAC Name:

4-methyl-2-(1-methylpyrazol-4-yl)-1,3-thiazole-5-carboxylic acid

InChI:

InChI=1S/C9H9N3O2S/c1-5-7(9(13)14)15-8(11-5)6-3-10-12(2)4-6/h3-4H,1-2H3,(H,13,14)

InChI Key:

NSJBEOGHKCBXCE-UHFFFAOYSA-N

SMILES:

Cn1ncc(c1)c1nc(c(s1)C(=O)O)C

Complexity:

264

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

223.042g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

223.25g/mol

Monoisotopic Mass:

223.042g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

96.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.2