T815-0712 Screening compound: 7-(3,5-dimethoxybenzoyl)-5H,6H,7H,8H-[1,2,4]triazolo[4,3-a]pyrazine

T815-0712 Screening compound: 7-(3,5-dimethoxybenzoyl)-5H,6H,7H,8H-[1,2,4]triazolo[4,3-a]pyrazine
T815-0712 Screening compound: 7-(3,5-dimethoxybenzoyl)-5H,6H,7H,8H-[1,2,4]triazolo[4,3-a]pyrazine alternative view

Chemical Structure Depiction of ChemDiv screening compound T815-0712
7-(3,5-dimethoxybenzoyl)-5H,6H,7H,8H-[1,2,4]triazolo[4,3-a]pyrazine

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

T815-0712

Molecular Formula

C14H16N4O3 (C14 H16 N4 O3)

Compound Name

7-(3,5-dimethoxybenzoyl)-5H,6H,7H,8H-[1,2,4]triazolo[4,3-a]pyrazine

IUPAC name

7-(35-dimethoxybenzoyl)-5H6H7H8H-[124]triazolo[43-a]pyrazine

SMILES

COc1cc(C(N2Cc3nncn3CC2)=O)cc(OC)c1

InChI

InChI=1S/C14H16N4O3/c1-20-11-5-10(6-12(7-11)21-2)14(19)17-3-4-18-9-15-16-13(18)8-17/h5-7,9H,3-4,8H2,1-2H3

InChI Key

URCPEUDEPPUEIQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29027539

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

288.31

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

0.268

Distribution Coefficient, logD

0.268

Water Solubility, LogSw

-0.84

Polar Surface Area

57.977

Acid Dissociation Constant (pKa)

20.38

Base Dissociation Constant (pKb)

4.01

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.70

T815-0712 in Drug Discovery

Included in Screening Libraries

Antiviral HBV Library (10007 compounds)

Antiviral Library (67538 compounds)

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

CNS MPO Library (28609 compounds)

Fragments Library (11262 compounds)

GABA Library (7115 compounds)

Protein-Protein Interaction Library (218420 compounds)

TLR-8 ligands Library (674 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Nervous system
  • Eye
  • Female
  • Skin
  • Immune system
Structure:
  • Fragments
  • Cyclic compounds
Targets:
  • GPCR
  • Ion Channels
  • Others
Mechanism of action:
  • Receptor's ligands
  • PPI modulators
  • Receptor's ligands

References: we are preparing a list of scientific research reports with T815-0712 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T815-0712?
Check Price and Availability of T815-0712, 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 T815-0712 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T815-0712
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T815-0712
  • 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 T815-0712 available by request