Name: Name:3-Quinolinecarboxylic acid, 6-ethoxy-4-hydroxy-
Brand: Angene
SKU: AG002ZMT
Rating: 90 (10 reviews)

3-Quinolinecarboxylic acid, 6-ethoxy-4-hydroxy-

CAS No.:

303121-10-0

Catalog Number:

AG002ZMT

Molecular Formula:

C12H11NO4

Molecular Weight:

233.2200

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Product Description

Catalog Number:

AG002ZMT

Chemical Name:

3-Quinolinecarboxylic acid, 6-ethoxy-4-hydroxy-

CAS Number:

303121-10-0

Molecular Formula:

C12H11NO4

Molecular Weight:

233.2200

MDL Number:

MFCD02217683

IUPAC Name:

6-ethoxy-4-oxo-1H-quinoline-3-carboxylic acid

InChI:

InChI=1S/C12H11NO4/c1-2-17-7-3-4-10-8(5-7)11(14)9(6-13-10)12(15)16/h3-6H,2H2,1H3,(H,13,14)(H,15,16)

InChI Key:

FRMATZBTAXOKFT-UHFFFAOYSA-N

SMILES:

CCOc1ccc2c(c1)c(O)c(cn2)C(=O)O

Properties

Complexity:

364

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

233.069g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

233.223g/mol

Monoisotopic Mass:

233.069g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

75.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.2

Literature

Title	Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.	Bioorganic & medicinal chemistry letters 20101101
Evaluation of 3-carboxy-4(1H)-quinolones as inhibitors of human protein kinase CK2.	Journal of medicinal chemistry 20061102
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