CAS 22433-76-7 | N-(quinolin-6-yl)acetaMide | CAS Number 22433-76-7

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22433-76-7 | N-(quinolin-6-yl)acetaMide

CAS No: 22433-76-7 Catalog No: AG00BIOK MDL No:MFCD00460662

Product Description

Catalog Number:

AG00BIOK

Chemical Name:

N-(quinolin-6-yl)acetaMide

CAS Number:

22433-76-7

Molecular Formula:

C11H10N2O

Molecular Weight:

186.2099

MDL Number:

MFCD00460662

IUPAC Name:

N-quinolin-6-ylacetamide

InChI:

InChI=1S/C11H10N2O/c1-8(14)13-10-4-5-11-9(7-10)3-2-6-12-11/h2-7H,1H3,(H,13,14)

InChI Key:

GJEUIVYGSBNNKW-UHFFFAOYSA-N

SMILES:

CC(=O)Nc1ccc2c(c1)cccn2

NSC Number:

405793

Properties

Complexity:

217

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

186.079g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

186.214g/mol

Monoisotopic Mass:

186.079g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

42A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.6

Literature

Title	Journal
Ionic interactions for substituted MCH1R inhibitors studied by pK(a) values.	Bioorganic & medicinal chemistry letters 20090801
Structure-activity relationships in quinoline Reissert derivatives with HIV-1 reverse transcriptase inhibitory activity.	Drug design and discovery 19970401