G639-3826 Screening compound: 1-(2-bromobenzoyl)-4-[5-(pyridin-2-yl)-1H-pyrazole-3-carbonyl]piperazine

G639-3826 Screening compound: 1-(2-bromobenzoyl)-4-[5-(pyridin-2-yl)-1H-pyrazole-3-carbonyl]piperazine
G639-3826 Screening compound: 1-(2-bromobenzoyl)-4-[5-(pyridin-2-yl)-1H-pyrazole-3-carbonyl]piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound G639-3826
1-(2-bromobenzoyl)-4-[5-(pyridin-2-yl)-1H-pyrazole-3-carbonyl]piperazine

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

G639-3826

Molecular Formula

C20H18BrN5O2 (C20 H18 BrN5 O2)

Compound Name

1-(2-bromobenzoyl)-4-[5-(pyridin-2-yl)-1H-pyrazole-3-carbonyl]piperazine

IUPAC name

1-(2-bromobenzoyl)-4-[5-(pyridin-2-yl)-1H-pyrazole-3-carbonyl]piperazine

SMILES

O=C(c1n[nH]c(-c2ncccc2)c1)N(CC1)CCN1C(c(cccc1)c1Br)=O

InChI

InChI=1S/C20H18BrN5O2/c21-15-6-2-1-5-14(15)19(27)25-9-11-26(12-10-25)20(28)18-13-17(23-24-18)16-7-3-4-8-22-16/h1-8,13H,9-12H2,(H,23,24)

InChI Key

YCSLXCKFWXYOCU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27148085

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

440.3

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.129

Distribution Coefficient, logD

2.128

Water Solubility, LogSw

-2.96

Polar Surface Area

64.881

Acid Dissociation Constant (pKa)

11.15

Base Dissociation Constant (pKb)

3.35

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

G639-3826 in Drug Discovery

Included in Screening Libraries

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

Protein Kinases Inhibitors Library (36801 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with G639-3826 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G639-3826?
Check Price and Availability of G639-3826, 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 G639-3826 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G639-3826
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G639-3826
  • 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 G639-3826 available by request