E835-0496 Screening compound: 1-[1-(4-chlorophenyl)-5-(piperidin-4-yl)-1H-pyrazole-4-carbonyl]-4-(furan-2-carbonyl)piperazine

E835-0496 Screening compound: 1-[1-(4-chlorophenyl)-5-(piperidin-4-yl)-1H-pyrazole-4-carbonyl]-4-(furan-2-carbonyl)piperazine
E835-0496 Screening compound: 1-[1-(4-chlorophenyl)-5-(piperidin-4-yl)-1H-pyrazole-4-carbonyl]-4-(furan-2-carbonyl)piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound E835-0496
1-[1-(4-chlorophenyl)-5-(piperidin-4-yl)-1H-pyrazole-4-carbonyl]-4-(furan-2-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

E835-0496

Molecular Formula

C24H26ClN5O3 (C24 H26 ClN5 O3)

Compound Name

1-[1-(4-chlorophenyl)-5-(piperidin-4-yl)-1H-pyrazole-4-carbonyl]-4-(furan-2-carbonyl)piperazine

IUPAC name

n/a

SMILES

O=C(c1c(C2CCNCC2)n(-c(cc2)ccc2Cl)nc1)N(CC1)CCN1C(c1ccco1)=O

InChI

InChI=1S/C24H26ClN5O3/c25-18-3-5-19(6-4-18)30-22(17-7-9-26-10-8-17)20(16-27-30)23(31)28-11-13-29(14-12-28)24(32)21-2-1-15-33-21/h1-6,15-17,26H,7-14H2

InChI Key

SHZYUSMLRDCVOQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14920699

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

467.96

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.602

Distribution Coefficient, logD

-1.879

Water Solubility, LogSw

-2.70

Polar Surface Area

66.897

Acid Dissociation Constant (pKa)

22.02

Base Dissociation Constant (pKb)

10.88

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.50

E835-0496 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Dark Chemical Matter Library (18430 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Pool

References: we are preparing a list of scientific research reports with E835-0496 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E835-0496?
Check Price and Availability of E835-0496, 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 E835-0496 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E835-0496
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E835-0496
  • 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 E835-0496 available by request