R311-0034 Screening compound: 1-[(4-methoxyphenyl)amino]isoquinoline-4-carboxylic acid

R311-0034 Screening compound: 1-[(4-methoxyphenyl)amino]isoquinoline-4-carboxylic acid
R311-0034 Screening compound: 1-[(4-methoxyphenyl)amino]isoquinoline-4-carboxylic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound R311-0034
1-[(4-methoxyphenyl)amino]isoquinoline-4-carboxylic acid

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

R311-0034

Molecular Formula

C17H14N2O3 (C17 H14 N2 O3)

Compound Name

1-[(4-methoxyphenyl)amino]isoquinoline-4-carboxylic acid

IUPAC name

1-[(4-methoxyphenyl)amino]isoquinoline-4-carboxylic acid

SMILES

COc(cc1)ccc1Nc1ncc(C(O)=O)c2ccccc12

InChI

InChI=1S/C17H14N2O3/c1-22-12-8-6-11(7-9-12)19-16-14-5-3-2-4-13(14)15(10-18-16)17(20)21/h2-10H,1H3,(H,18,19)(H,20,21)

InChI Key

OZVINBSCSRJWHN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03449318

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

294.31

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.608

Distribution Coefficient, logD

1.754

Water Solubility, LogSw

-3.66

Polar Surface Area

54.608

Acid Dissociation Constant (pKa)

5.55

Base Dissociation Constant (pKb)

3.66

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.90

R311-0034 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Anti-Aging Library (44940 compounds)

CNS Targets (44014 compounds)

Cardiovascular Library (22201 compounds)

Dark Chemical Matter Library (18430 compounds)

Macl-GPIb alpha Interaction Library (22969 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

RAR (Nuclear receptors) Ligands Library (6524 compounds)

SmartTM Library (51161 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Ion Channels Focused Library (26372 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Pool
Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Nervous system
  • Cardiovascular
  • Hemic and lymphatic
  • Cardiovascular
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
  • Cancer
  • Respiratory tract
  • Eye
  • Male
  • Female
  • Hemic and lymphatic
  • Congenital
  • Skin
  • Endocrine
  • Immune system
  • Nervous system
  • Cardiovascular
Mechanism of action:
  • Epigenetic
  • Receptor's ligands
Targets:
  • Kinases
  • Nuclear receptors
  • Ion Channels

References: we are preparing a list of scientific research reports with R311-0034 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound R311-0034?
Check Price and Availability of R311-0034, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of R311-0034 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for R311-0034
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for R311-0034
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of R311-0034 available by request