J015-0032 Screening compound: 2-[6-(4H-1,2,4-triazol-4-yl)pyridine-2-amido]benzoic acid

J015-0032 Screening compound: 2-[6-(4H-1,2,4-triazol-4-yl)pyridine-2-amido]benzoic acid
J015-0032 Screening compound: 2-[6-(4H-1,2,4-triazol-4-yl)pyridine-2-amido]benzoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound J015-0032
2-[6-(4H-1,2,4-triazol-4-yl)pyridine-2-amido]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

J015-0032

Molecular Formula

C15H11N5O3 (C15 H11 N5 O3)

Compound Name

2-[6-(4H-1,2,4-triazol-4-yl)pyridine-2-amido]benzoic acid

IUPAC name

2-[6-(4H-124-triazol-4-yl)pyridine-2-amido]benzoic acid

SMILES

OC(c(cccc1)c1NC(c1nc(-n2cnnc2)ccc1)=O)=O

InChI

InChI=1S/C15H11N5O3/c21-14(19-11-5-2-1-4-10(11)15(22)23)12-6-3-7-13(18-12)20-8-16-17-9-20/h1-9H,(H,19,21)(H,22,23)

InChI Key

TVQCSAYOHBVRNI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15078191

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

309.28

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.283

Distribution Coefficient, logD

-2.543

Water Solubility, LogSw

-2.93

Polar Surface Area

85.151

Acid Dissociation Constant (pKa)

2.57

Base Dissociation Constant (pKb)

2.70

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

J015-0032 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Macl-GPIb alpha Interaction Library (22969 compounds)

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Hemic and lymphatic
  • Cardiovascular
Mechanism of action:
  • Epigenetic
  • PPI modulators

References: we are preparing a list of scientific research reports with J015-0032 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J015-0032?
Check Price and Availability of J015-0032, 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 J015-0032 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J015-0032
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J015-0032
  • 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 J015-0032 available by request