G639-1209 Screening compound: N-[(2-chlorophenyl)methyl]-1-[5-(pyridin-4-yl)-1H-pyrazole-3-carbonyl]piperidine-4-carboxamide

G639-1209 Screening compound: N-[(2-chlorophenyl)methyl]-1-[5-(pyridin-4-yl)-1H-pyrazole-3-carbonyl]piperidine-4-carboxamide
G639-1209 Screening compound: N-[(2-chlorophenyl)methyl]-1-[5-(pyridin-4-yl)-1H-pyrazole-3-carbonyl]piperidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G639-1209
N-[(2-chlorophenyl)methyl]-1-[5-(pyridin-4-yl)-1H-pyrazole-3-carbonyl]piperidine-4-carboxamide

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

G639-1209

Molecular Formula

C22H22ClN5O2 (C22 H22 ClN5 O2)

Compound Name

N-[(2-chlorophenyl)methyl]-1-[5-(pyridin-4-yl)-1H-pyrazole-3-carbonyl]piperidine-4-carboxamide

IUPAC name

N-[(2-chlorophenyl)methyl]-1-[5-(pyridin-4-yl)-1H-pyrazole-3-carbonyl]piperidine-4-carboxamide

SMILES

O=C(C(CC1)CCN1C(c1n[nH]c(-c2ccncc2)c1)=O)NCc(cccc1)c1Cl

InChI

InChI=1S/C22H22ClN5O2/c23-18-4-2-1-3-17(18)14-25-21(29)16-7-11-28(12-8-16)22(30)20-13-19(26-27-20)15-5-9-24-10-6-15/h1-6,9-10,13,16H,7-8,11-12,14H2,(H,25,29)(H,26,27)

InChI Key

ONOBYNWZSHKNBB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27147452

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

423.9

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.480

Distribution Coefficient, logD

2.479

Water Solubility, LogSw

-3.45

Polar Surface Area

73.218

Acid Dissociation Constant (pKa)

11.74

Base Dissociation Constant (pKb)

4.88

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

G639-1209 in Drug Discovery

Included in Screening Libraries

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

CNS Targets (44014 compounds)

CORONAVIRUS Library (20774 compounds)

Immunological Library (6760 compounds)

Macl-GPIb alpha Interaction Library (22969 compounds)

Nonpeptide Peptidomimetics PPI Library (18997 compounds)

PLpro Library (6343 compounds)

Protein-Protein Interaction Library (218420 compounds)

Indoleamine 2,3-dioxygenase 1 Focused Library (5816 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Antiviral
  • Infections
  • Immune system
  • Immune system
  • Hemic and lymphatic
  • Cardiovascular
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Digestive system
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Immune system
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
Targets:
  • Others

References: we are preparing a list of scientific research reports with G639-1209 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G639-1209?
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What is the minimum amount of G639-1209 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G639-1209
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G639-1209
  • 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 G639-1209 available by request