Name: Name:1-(1H-Benzimidazol-2-ylmethyl)cyclopentanecarboxylic acid
Brand: Angene
SKU: AG00IDLN
Rating: 90 (10 reviews)

1-(1H-Benzimidazol-2-ylmethyl)cyclopentanecarboxylic acid

CAS No.:

852399-56-5

Catalog Number:

AG00IDLN

Molecular Formula:

C14H16N2O2

Molecular Weight:

244.2890

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Product Description

Catalog Number:

AG00IDLN

Chemical Name:

1-(1H-Benzimidazol-2-ylmethyl)cyclopentanecarboxylic acid

CAS Number:

852399-56-5

Molecular Formula:

C14H16N2O2

Molecular Weight:

244.2890

MDL Number:

MFCD06655500

IUPAC Name:

1-(1H-benzimidazol-2-ylmethyl)cyclopentane-1-carboxylic acid

InChI:

InChI=1S/C14H16N2O2/c17-13(18)14(7-3-4-8-14)9-12-15-10-5-1-2-6-11(10)16-12/h1-2,5-6H,3-4,7-9H2,(H,15,16)(H,17,18)

InChI Key:

TWOKXLOYDCTMAJ-UHFFFAOYSA-N

SMILES:

OC(=O)C1(CCCC1)Cc1nc2c([nH]1)cccc2

Properties

Complexity:

326

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

244.121g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

244.294g/mol

Monoisotopic Mass:

244.121g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

66A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.5

Literature

Title	Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.	Bioorganic & medicinal chemistry letters 20101101
Microsphere-based protease assays and screening application for lethal factor and factor Xa.	Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501