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Home Halogens 2-chloro-N-cyclopropylquinoline-4-carboxamide

2-chloro-N-cyclopropylquinoline-4-carboxamide

CAS No.:
874594-10-2
Catalog Number:
AG019OUW
Molecular Formula:
C13H11ClN2O
Molecular Weight:
246.6922
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Product Description
Catalog Number:
AG019OUW
Chemical Name:
2-chloro-N-cyclopropylquinoline-4-carboxamide
CAS Number:
874594-10-2
Molecular Formula:
C13H11ClN2O
Molecular Weight:
246.6922
MDL Number:
MFCD00444357
IUPAC Name:
2-chloro-N-cyclopropylquinoline-4-carboxamide
InChI:
InChI=1S/C13H11ClN2O/c14-12-7-10(13(17)15-8-5-6-8)9-3-1-2-4-11(9)16-12/h1-4,7-8H,5-6H2,(H,15,17)
InChI Key:
ISHDXJSQWOQIHZ-UHFFFAOYSA-N
SMILES:
Clc1nc2ccccc2c(c1)C(=O)NC1CC1
Properties
Complexity:
306  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.056g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
246.694g/mol
Monoisotopic Mass:
246.056g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
42A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6  
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
Properties