E835-0530 Screening compound: 1-[1-(4-chlorophenyl)-5-(piperidin-4-yl)-1H-pyrazole-4-carbonyl]-4-(4-methoxyphenyl)piperazine

E835-0530 Screening compound: 1-[1-(4-chlorophenyl)-5-(piperidin-4-yl)-1H-pyrazole-4-carbonyl]-4-(4-methoxyphenyl)piperazine
E835-0530 Screening compound: 1-[1-(4-chlorophenyl)-5-(piperidin-4-yl)-1H-pyrazole-4-carbonyl]-4-(4-methoxyphenyl)piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound E835-0530
1-[1-(4-chlorophenyl)-5-(piperidin-4-yl)-1H-pyrazole-4-carbonyl]-4-(4-methoxyphenyl)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

E835-0530

Molecular Formula

C26H30ClN5O2 (C26 H30 ClN5 O2)

Compound Name

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

IUPAC name

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

SMILES

COc(cc1)ccc1N(CC1)CCN1C(c1c(C2CCNCC2)n(-c(cc2)ccc2Cl)nc1)=O

InChI

InChI=1S/C26H30ClN5O2/c1-34-23-8-6-21(7-9-23)30-14-16-31(17-15-30)26(33)24-18-29-32(22-4-2-20(27)3-5-22)25(24)19-10-12-28-13-11-19/h2-9,18-19,28H,10-17H2,1H3

InChI Key

XLLAGTKEKNFWJQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14920703

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

480.01

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.133

Distribution Coefficient, logD

-0.348

Water Solubility, LogSw

-3.54

Polar Surface Area

52.666

Acid Dissociation Constant (pKa)

22.02

Base Dissociation Constant (pKb)

10.88

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.50

References: we are preparing a list of scientific research reports with E835-0530 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E835-0530?
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What is the minimum amount of E835-0530 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E835-0530
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E835-0530
  • 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 E835-0530 available by request