P709-1249 Screening compound: 2-{1-[5-(3-tert-butyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]-5-methyl-1H-pyrazole-4-carbonyl}-1,2,3,4-tetrahydroisoquinoline

P709-1249 Screening compound: 2-{1-[5-(3-tert-butyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]-5-methyl-1H-pyrazole-4-carbonyl}-1,2,3,4-tetrahydroisoquinoline
P709-1249 Screening compound: 2-{1-[5-(3-tert-butyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]-5-methyl-1H-pyrazole-4-carbonyl}-1,2,3,4-tetrahydroisoquinoline alternative view

Chemical Structure Depiction of ChemDiv screening compound P709-1249
2-{1-[5-(3-tert-butyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]-5-methyl-1H-pyrazole-4-carbonyl}-1,2,3,4-tetrahydroisoquinoline

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

P709-1249

Molecular Formula

C25H26N6O2 (C25 H26 N6 O2)

Compound Name

2-{1-[5-(3-tert-butyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]-5-methyl-1H-pyrazole-4-carbonyl}-1,2,3,4-tetrahydroisoquinoline

IUPAC name

2-{1-[5-(3-tert-butyl-124-oxadiazol-5-yl)pyridin-2-yl]-5-methyl-1H-pyrazole-4-carbonyl}-1234-tetrahydroisoquinoline

SMILES

CC(C)(C)c1noc(-c(cc2)cnc2-n2ncc(C(N(CC3)Cc4c3cccc4)=O)c2C)n1

InChI

InChI=1S/C25H26N6O2/c1-16-20(23(32)30-12-11-17-7-5-6-8-19(17)15-30)14-27-31(16)21-10-9-18(13-26-21)22-28-24(29-33-22)25(2,3)4/h5-10,13-14H,11-12,15H2,1-4H3

InChI Key

LNYNMZVMCPJQBG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27613493

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

442.52

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.759

Distribution Coefficient, logD

4.756

Water Solubility, LogSw

-4.40

Polar Surface Area

70.892

Acid Dissociation Constant (pKa)

24.26

Base Dissociation Constant (pKb)

5.08

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

32.00

P709-1249 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with P709-1249 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P709-1249?
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What is the minimum amount of P709-1249 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P709-1249
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P709-1249
  • 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 P709-1249 available by request