G857-2232 Screening compound: N-(2,4-difluorophenyl)-3-methyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-amine

G857-2232 Screening compound: N-(2,4-difluorophenyl)-3-methyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-amine
G857-2232 Screening compound: N-(2,4-difluorophenyl)-3-methyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound G857-2232
N-(2,4-difluorophenyl)-3-methyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-amine

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

G857-2232

Molecular Formula

C11H8F2N6 (C11 H8 F2 N6)

Compound Name

N-(2,4-difluorophenyl)-3-methyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-amine

IUPAC name

N-(24-difluorophenyl)-3-methyl-3H-[123]triazolo[45-d]pyrimidin-7-amine

SMILES

Cn1nnc2c1ncnc2Nc(ccc(F)c1)c1F

InChI

InChI=1S/C11H8F2N6/c1-19-11-9(17-18-19)10(14-5-15-11)16-8-3-2-6(12)4-7(8)13/h2-5H,1H3,(H,14,15,16)

InChI Key

GZPCZTPPVIBYFB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07806568

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

262.22

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.613

Distribution Coefficient, logD

1.613

Water Solubility, LogSw

-1.62

Polar Surface Area

56.516

Acid Dissociation Constant (pKa)

13.29

Base Dissociation Constant (pKb)

3.10

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.09

G857-2232 in Drug Discovery

Included in Screening Libraries

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

Fragments Library (11262 compounds)

Soluble Diversity Library (15920 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Structure:
  • Fragments

References: we are preparing a list of scientific research reports with G857-2232 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G857-2232?
Check Price and Availability of G857-2232, 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 G857-2232 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G857-2232
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G857-2232
  • 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 G857-2232 available by request