Name: Name:2-(1H-1,3-benzodiazol-2-yl)-1-(thiophen-2-yl)ethan-1-one
Brand: Angene
SKU: AG019GVK
Rating: 90 (10 reviews)

2-(1H-1,3-benzodiazol-2-yl)-1-(thiophen-2-yl)ethan-1-one

CAS No.:

728907-97-9

Catalog Number:

AG019GVK

Molecular Formula:

C13H10N2OS

Molecular Weight:

242.2963

Catalog Number:

AG019GVK

Chemical Name:

2-(1H-1,3-benzodiazol-2-yl)-1-(thiophen-2-yl)ethan-1-one

CAS Number:

728907-97-9

Molecular Formula:

C13H10N2OS

Molecular Weight:

242.2963

MDL Number:

MFCD03966861

IUPAC Name:

2-(1H-benzimidazol-2-yl)-1-thiophen-2-ylethanone

InChI:

InChI=1S/C13H10N2OS/c16-11(12-6-3-7-17-12)8-13-14-9-4-1-2-5-10(9)15-13/h1-7H,8H2,(H,14,15)

InChI Key:

CJAQHQYQSUKLNY-UHFFFAOYSA-N

SMILES:

O=C(c1cccs1)Cc1nc2c([nH]1)cccc2

Complexity:

297

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

242.051g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

242.296g/mol

Monoisotopic Mass:

242.051g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

74A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.8