P032-2744 Screening compound: N-[2-(cyclohex-1-en-1-yl)ethyl]-2-[5-methyl-3-oxo-7-(pyridin-2-yl)-2H,3H-[1,2,4]triazolo[4,3-c]pyrimidin-2-yl]acetamide

P032-2744 Screening compound: N-[2-(cyclohex-1-en-1-yl)ethyl]-2-[5-methyl-3-oxo-7-(pyridin-2-yl)-2H,3H-[1,2,4]triazolo[4,3-c]pyrimidin-2-yl]acetamide
P032-2744 Screening compound: N-[2-(cyclohex-1-en-1-yl)ethyl]-2-[5-methyl-3-oxo-7-(pyridin-2-yl)-2H,3H-[1,2,4]triazolo[4,3-c]pyrimidin-2-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P032-2744
N-[2-(cyclohex-1-en-1-yl)ethyl]-2-[5-methyl-3-oxo-7-(pyridin-2-yl)-2H,3H-[1,2,4]triazolo[4,3-c]pyrimidin-2-yl]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

P032-2744

Molecular Formula

C21H24N6O2 (C21 H24 N6 O2)

Compound Name

N-[2-(cyclohex-1-en-1-yl)ethyl]-2-[5-methyl-3-oxo-7-(pyridin-2-yl)-2H,3H-[1,2,4]triazolo[4,3-c]pyrimidin-2-yl]acetamide

IUPAC name

N-[2-(cyclohex-1-en-1-yl)ethyl]-2-[5-methyl-3-oxo-7-(pyridin-2-yl)-2H3H-[124]triazolo[43-c]pyrimidin-2-yl]acetamide

SMILES

CC(N12)=NC(c3ncccc3)=CC2=NN(CC(NCCC2=CCCCC2)=O)C1=O

InChI

InChI=1S/C21H24N6O2/c1-15-24-18(17-9-5-6-11-22-17)13-19-25-26(21(29)27(15)19)14-20(28)23-12-10-16-7-3-2-4-8-16/h5-7,9,11,13H,2-4,8,10,12,14H2,1H3,(H,23,28)

InChI Key

YCKHRQARQRFZET-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27559367

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

392.46

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.731

Distribution Coefficient, logD

1.722

Water Solubility, LogSw

-2.21

Polar Surface Area

74.542

Acid Dissociation Constant (pKa)

15.86

Base Dissociation Constant (pKb)

5.69

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.10

P032-2744 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 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 P032-2744 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P032-2744?
Check Price and Availability of P032-2744, 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 P032-2744 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P032-2744
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P032-2744
  • 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 P032-2744 available by request