D494-0491 Screening compound: N-(2-ethoxyphenyl)-2-{[5-methyl-2-(pyridin-3-yl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]amino}acetamide

D494-0491 Screening compound: N-(2-ethoxyphenyl)-2-{[5-methyl-2-(pyridin-3-yl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]amino}acetamide
D494-0491 Screening compound: N-(2-ethoxyphenyl)-2-{[5-methyl-2-(pyridin-3-yl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]amino}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D494-0491
N-(2-ethoxyphenyl)-2-{[5-methyl-2-(pyridin-3-yl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]amino}acetamide

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

D494-0491

Molecular Formula

C21H21N7O2 (C21 H21 N7 O2)

Compound Name

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

IUPAC name

N-(2-ethoxyphenyl)-2-{[5-methyl-2-(pyridin-3-yl)-[124]triazolo[15-a]pyrimidin-7-yl]amino}acetamide

SMILES

CCOc(cccc1)c1NC(CNc1cc(C)nc2nc(-c3cnccc3)nn12)=O

InChI

InChI=1S/C21H21N7O2/c1-3-30-17-9-5-4-8-16(17)25-19(29)13-23-18-11-14(2)24-21-26-20(27-28(18)21)15-7-6-10-22-12-15/h4-12,23H,3,13H2,1-2H3,(H,25,29)

InChI Key

WAHGIDSOJFMCED-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27589440

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

403.44

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.287

Distribution Coefficient, logD

2.144

Water Solubility, LogSw

-2.70

Polar Surface Area

80.342

Acid Dissociation Constant (pKa)

11.39

Base Dissociation Constant (pKb)

6.99

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.00

D494-0491 in Drug Discovery

Included in Screening Libraries

Protein Arginine Methyltransferases Library (27925 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with D494-0491 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D494-0491?
Check Price and Availability of D494-0491, 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 D494-0491 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D494-0491
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D494-0491
  • 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 D494-0491 available by request