G639-3525 Screening compound: 1-[5-(pyridin-4-yl)-1H-pyrazole-3-carbonyl]-4-(pyridine-4-carbonyl)piperazine

G639-3525 Screening compound: 1-[5-(pyridin-4-yl)-1H-pyrazole-3-carbonyl]-4-(pyridine-4-carbonyl)piperazine
G639-3525 Screening compound: 1-[5-(pyridin-4-yl)-1H-pyrazole-3-carbonyl]-4-(pyridine-4-carbonyl)piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound G639-3525
1-[5-(pyridin-4-yl)-1H-pyrazole-3-carbonyl]-4-(pyridine-4-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

G639-3525

Molecular Formula

C19H18N6O2 (C19 H18 N6 O2)

Compound Name

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

IUPAC name

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

SMILES

O=C(c1n[nH]c(-c2ccncc2)c1)N(CC1)CCN1C(c1ccncc1)=O

InChI

InChI=1S/C19H18N6O2/c26-18(15-3-7-21-8-4-15)24-9-11-25(12-10-24)19(27)17-13-16(22-23-17)14-1-5-20-6-2-14/h1-8,13H,9-12H2,(H,22,23)

InChI Key

CWWZAAJRZWTEKO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27147972

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

362.39

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

0.236

Distribution Coefficient, logD

0.234

Water Solubility, LogSw

-1.04

Polar Surface Area

74.689

Acid Dissociation Constant (pKa)

11.74

Base Dissociation Constant (pKb)

5.14

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.10

G639-3525 in Drug Discovery

Included in Screening Libraries

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

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G639-3525 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G639-3525?
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What is the minimum amount of G639-3525 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G639-3525
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G639-3525
  • 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 G639-3525 available by request