D494-0723 Screening compound: 4-{[5-methyl-2-(pyridin-3-yl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]amino}phenyl 2-methylpropanoate

D494-0723 Screening compound: 4-{[5-methyl-2-(pyridin-3-yl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]amino}phenyl 2-methylpropanoate
D494-0723 Screening compound: 4-{[5-methyl-2-(pyridin-3-yl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]amino}phenyl 2-methylpropanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound D494-0723
4-{[5-methyl-2-(pyridin-3-yl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]amino}phenyl 2-methylpropanoate

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

D494-0723

Molecular Formula

C21H20N6O2 (C21 H20 N6 O2)

Compound Name

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

IUPAC name

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

SMILES

CC(C)C(Oc(cc1)ccc1Nc1cc(C)nc2nc(-c3cnccc3)nn12)=O

InChI

InChI=1S/C21H20N6O2/c1-13(2)20(28)29-17-8-6-16(7-9-17)24-18-11-14(3)23-21-25-19(26-27(18)21)15-5-4-10-22-12-15/h4-13,24H,1-3H3

InChI Key

MPHDJJOESJHVPN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27589511

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

388.43

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.325

Distribution Coefficient, logD

3.183

Water Solubility, LogSw

-3.56

Polar Surface Area

70.007

Acid Dissociation Constant (pKa)

16.91

Base Dissociation Constant (pKb)

6.99

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.00

D494-0723 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

Anti-Aging Library (44940 compounds)

C-Met Library (15277 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Endocrine
Mechanism of action:
  • Epigenetic
  • Receptor's ligands
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with D494-0723 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D494-0723?
Check Price and Availability of D494-0723, 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 D494-0723 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D494-0723
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D494-0723
  • 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 D494-0723 available by request