G639-3497 Screening compound: 1-(5-bromopyridine-3-carbonyl)-4-[5-(pyridin-4-yl)-1H-pyrazole-3-carbonyl]piperazine

G639-3497 Screening compound: 1-(5-bromopyridine-3-carbonyl)-4-[5-(pyridin-4-yl)-1H-pyrazole-3-carbonyl]piperazine
G639-3497 Screening compound: 1-(5-bromopyridine-3-carbonyl)-4-[5-(pyridin-4-yl)-1H-pyrazole-3-carbonyl]piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound G639-3497
1-(5-bromopyridine-3-carbonyl)-4-[5-(pyridin-4-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

G639-3497

Molecular Formula

C19H17BrN6O2 (C19 H17 BrN6 O2)

Compound Name

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

IUPAC name

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

SMILES

O=C(c1n[nH]c(-c2ccncc2)c1)N(CC1)CCN1C(c1cc(Br)cnc1)=O

InChI

InChI=1S/C19H17BrN6O2/c20-15-9-14(11-22-12-15)18(27)25-5-7-26(8-6-25)19(28)17-10-16(23-24-17)13-1-3-21-4-2-13/h1-4,9-12H,5-8H2,(H,23,24)

InChI Key

QGDZEMACLCFCJZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27147956

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

441.29

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.415

Distribution Coefficient, logD

1.414

Water Solubility, LogSw

-1.43

Polar Surface Area

74.868

Acid Dissociation Constant (pKa)

11.74

Base Dissociation Constant (pKb)

4.88

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.10

G639-3497 in Drug Discovery

Included in Screening Libraries

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

SmartTM Library (51161 compounds)

Epigenetics Focused Set (26518 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with G639-3497 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G639-3497?
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What is the minimum amount of G639-3497 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G639-3497
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G639-3497
  • 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 G639-3497 available by request