G856-5816 Screening compound: 1-{3-METHYL-3H-[1,2,3]TRIAZOLO[4,5-D]PYRIMIDIN-7-YL}PYRROLIDINE

G856-5816 Screening compound: 1-{3-METHYL-3H-[1,2,3]TRIAZOLO[4,5-D]PYRIMIDIN-7-YL}PYRROLIDINE
G856-5816 Screening compound: 1-{3-METHYL-3H-[1,2,3]TRIAZOLO[4,5-D]PYRIMIDIN-7-YL}PYRROLIDINE alternative view

Chemical Structure Depiction of ChemDiv screening compound G856-5816
1-{3-METHYL-3H-[1,2,3]TRIAZOLO[4,5-D]PYRIMIDIN-7-YL}PYRROLIDINE

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

G856-5816

Molecular Formula

C9H12N6 (C9 H12 N6)

Compound Name

1-{3-METHYL-3H-[1,2,3]TRIAZOLO[4,5-D]PYRIMIDIN-7-YL}PYRROLIDINE

IUPAC name

n/a

SMILES

Cn1nnc2c1ncnc2N1CCCC1

InChI

InChI=1S/C9H12N6/c1-14-8-7(12-13-14)9(11-6-10-8)15-4-2-3-5-15/h6H,2-5H2,1H3

InChI Key

YZDWZJVTUGIYKS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07653965

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

204.23

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

0.763

Distribution Coefficient, logD

0.762

Water Solubility, LogSw

-0.75

Polar Surface Area

51.413

Acid Dissociation Constant (pKa)

20.64

Base Dissociation Constant (pKb)

3.51

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.00

G856-5816 in Drug Discovery

Included in Screening Libraries

Fragments Library (11262 compounds)

Soluble Diversity Library (15920 compounds)

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Structure:
  • Fragments
Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with G856-5816 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G856-5816?
Check Price and Availability of G856-5816, 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 G856-5816 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G856-5816
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G856-5816
  • 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 G856-5816 available by request