D494-0752 Screening compound: 4-{[5-methyl-2-(pyridin-3-yl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]amino}phenyl pyridine-2-carboxylate

D494-0752 Screening compound: 4-{[5-methyl-2-(pyridin-3-yl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]amino}phenyl pyridine-2-carboxylate
D494-0752 Screening compound: 4-{[5-methyl-2-(pyridin-3-yl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]amino}phenyl pyridine-2-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound D494-0752
4-{[5-methyl-2-(pyridin-3-yl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]amino}phenyl pyridine-2-carboxylate

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

D494-0752

Molecular Formula

C23H17N7O2 (C23 H17 N7 O2)

Compound Name

4-{[5-methyl-2-(pyridin-3-yl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]amino}phenyl pyridine-2-carboxylate

IUPAC name

4-{[5-methyl-2-(pyridin-3-yl)-[124]triazolo[15-a]pyrimidin-7-yl]amino}phenyl pyridine-2-carboxylate

SMILES

Cc1nc2nc(-c3cnccc3)nn2c(Nc(cc2)ccc2OC(c2ncccc2)=O)c1

InChI

InChI=1S/C23H17N7O2/c1-15-13-20(30-23(26-15)28-21(29-30)16-5-4-11-24-14-16)27-17-7-9-18(10-8-17)32-22(31)19-6-2-3-12-25-19/h2-14,27H,1H3

InChI Key

VOLUWFMMENDUSI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27589535

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

423.43

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.709

Distribution Coefficient, logD

2.566

Water Solubility, LogSw

-3.21

Polar Surface Area

78.784

Acid Dissociation Constant (pKa)

16.91

Base Dissociation Constant (pKb)

6.99

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.30

D494-0752 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

Anti-Inflammatory Library (24602 compounds)

C-Met Library (15277 compounds)

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Immune system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Endocrine
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases
  • Kinases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with D494-0752 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D494-0752?
Check Price and Availability of D494-0752, 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 D494-0752 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D494-0752
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D494-0752
  • 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 D494-0752 available by request