P706-0230 Screening compound: 2-{1-[5-(3-ethyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]-1H-imidazole-4-carbonyl}-1,2,3,4-tetrahydroisoquinoline

P706-0230 Screening compound: 2-{1-[5-(3-ethyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]-1H-imidazole-4-carbonyl}-1,2,3,4-tetrahydroisoquinoline
P706-0230 Screening compound: 2-{1-[5-(3-ethyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]-1H-imidazole-4-carbonyl}-1,2,3,4-tetrahydroisoquinoline alternative view

Chemical Structure Depiction of ChemDiv screening compound P706-0230
2-{1-[5-(3-ethyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]-1H-imidazole-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

P706-0230

Molecular Formula

C22H20N6O2 (C22 H20 N6 O2)

Compound Name

2-{1-[5-(3-ethyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]-1H-imidazole-4-carbonyl}-1,2,3,4-tetrahydroisoquinoline

IUPAC name

2-{1-[5-(3-ethyl-124-oxadiazol-5-yl)pyridin-2-yl]-1H-imidazole-4-carbonyl}-1234-tetrahydroisoquinoline

SMILES

CCc1noc(-c(cc2)cnc2-n2cnc(C(N(CC3)Cc4c3cccc4)=O)c2)n1

InChI

InChI=1S/C22H20N6O2/c1-2-19-25-21(30-26-19)16-7-8-20(23-11-16)28-13-18(24-14-28)22(29)27-10-9-15-5-3-4-6-17(15)12-27/h3-8,11,13-14H,2,9-10,12H2,1H3

InChI Key

AXKHOSCEWJIKTG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27613090

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

400.44

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

3.556

Distribution Coefficient, logD

3.422

Water Solubility, LogSw

-3.29

Polar Surface Area

70.056

Acid Dissociation Constant (pKa)

25.61

Base Dissociation Constant (pKb)

6.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.70

P706-0230 in Drug Discovery

Included in Screening Libraries

SmartTM Library (51161 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • 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 P706-0230 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P706-0230?
Check Price and Availability of P706-0230, 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 P706-0230 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P706-0230
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P706-0230
  • 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 P706-0230 available by request