7465-0282 Screening compound: 3-{[(pyridin-4-yl)methyl]amino}benzoic acid

7465-0282 Screening compound: 3-{[(pyridin-4-yl)methyl]amino}benzoic acid
7465-0282 Screening compound: 3-{[(pyridin-4-yl)methyl]amino}benzoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 7465-0282
3-{[(pyridin-4-yl)methyl]amino}benzoic 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

7465-0282

Molecular Formula

C13H12N2O2 (C13 H12 N2 O2)

Compound Name

3-{[(pyridin-4-yl)methyl]amino}benzoic acid

IUPAC name

3-{[(pyridin-4-yl)methyl]amino}benzoic acid

SMILES

OC(c1cc(NCc2ccncc2)ccc1)=O

InChI

InChI=1S/C13H12N2O2/c16-13(17)11-2-1-3-12(8-11)15-9-10-4-6-14-7-5-10/h1-8,15H,9H2,(H,16,17)

InChI Key

CFXLJICVRPHVAR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04560855

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

228.25

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

1.939

Distribution Coefficient, logD

-0.942

Water Solubility, LogSw

-1.97

Polar Surface Area

48.309

Acid Dissociation Constant (pKa)

4.52

Base Dissociation Constant (pKb)

5.09

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

7.70

7465-0282 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Anti-Aging Library (44940 compounds)

CNS Targets (44014 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

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

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Nervous system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 7465-0282 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7465-0282?
Check Price and Availability of 7465-0282, 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 7465-0282 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7465-0282
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7465-0282
  • 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 7465-0282 available by request