Name: Name:2-(methylsulfanyl)-1-phenyl-1H-imidazole-5-carboxylic acid
Brand: Angene
SKU: AG00IDL4
Rating: 90 (10 reviews)

2-(methylsulfanyl)-1-phenyl-1H-imidazole-5-carboxylic acid

CAS No.:

852217-76-6

Catalog Number:

AG00IDL4

Molecular Formula:

C11H10N2O2S

Molecular Weight:

234.2743

Catalog Number:

AG00IDL4

Chemical Name:

2-(methylsulfanyl)-1-phenyl-1H-imidazole-5-carboxylic acid

CAS Number:

852217-76-6

Molecular Formula:

C11H10N2O2S

Molecular Weight:

234.2743

MDL Number:

MFCD06655356

IUPAC Name:

2-methylsulfanyl-3-phenylimidazole-4-carboxylic acid

InChI:

InChI=1S/C11H10N2O2S/c1-16-11-12-7-9(10(14)15)13(11)8-5-3-2-4-6-8/h2-7H,1H3,(H,14,15)

InChI Key:

NYRLRKPYIWJTTG-UHFFFAOYSA-N

SMILES:

CSc1ncc(n1c1ccccc1)C(=O)O

Complexity:

256

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

234.046g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

234.273g/mol

Monoisotopic Mass:

234.046g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

80.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.4