E822-0243 Screening compound: 1-[3-(4-chlorophenyl)-1H-pyrazole-5-carbonyl]-4-(diphenylmethyl)piperazine

E822-0243 Screening compound: 1-[3-(4-chlorophenyl)-1H-pyrazole-5-carbonyl]-4-(diphenylmethyl)piperazine
E822-0243 Screening compound: 1-[3-(4-chlorophenyl)-1H-pyrazole-5-carbonyl]-4-(diphenylmethyl)piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound E822-0243
1-[3-(4-chlorophenyl)-1H-pyrazole-5-carbonyl]-4-(diphenylmethyl)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

E822-0243

Molecular Formula

C27H25ClN4O (C27 H25 ClN4 O)

Compound Name

1-[3-(4-chlorophenyl)-1H-pyrazole-5-carbonyl]-4-(diphenylmethyl)piperazine

IUPAC name

1-[3-(4-chlorophenyl)-1H-pyrazole-5-carbonyl]-4-(diphenylmethyl)piperazine

SMILES

O=C(c1cc(-c(cc2)ccc2Cl)n[nH]1)N(CC1)CCN1C(c1ccccc1)c1ccccc1

InChI

InChI=1S/C27H25ClN4O/c28-23-13-11-20(12-14-23)24-19-25(30-29-24)27(33)32-17-15-31(16-18-32)26(21-7-3-1-4-8-21)22-9-5-2-6-10-22/h1-14,19,26H,15-18H2,(H,29,30)

InChI Key

KSRVCAQEMJGTBK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14920116

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

456.97

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.932

Distribution Coefficient, logD

5.929

Water Solubility, LogSw

-6.35

Polar Surface Area

41.938

Acid Dissociation Constant (pKa)

10.31

Base Dissociation Constant (pKb)

4.97

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.50

E822-0243 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

DGK Inhibitors Library (10558 compounds)

GPCR Targeted Library (31838 compounds)

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Nervous system
Targets:
  • Kinases
  • GPCR
  • GPCR
  • Ion Channels
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with E822-0243 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E822-0243?
Check Price and Availability of E822-0243, 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 E822-0243 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E822-0243
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E822-0243
  • 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 E822-0243 available by request