C590-0164 Screening compound: 1-(4-methoxybenzenesulfonyl)-4-[3-(4-methoxyphenyl)-1H-pyrazole-5-carbonyl]piperazine

C590-0164 Screening compound: 1-(4-methoxybenzenesulfonyl)-4-[3-(4-methoxyphenyl)-1H-pyrazole-5-carbonyl]piperazine
C590-0164 Screening compound: 1-(4-methoxybenzenesulfonyl)-4-[3-(4-methoxyphenyl)-1H-pyrazole-5-carbonyl]piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound C590-0164
1-(4-methoxybenzenesulfonyl)-4-[3-(4-methoxyphenyl)-1H-pyrazole-5-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

C590-0164

Molecular Formula

C22H24N4O5S (C22 H24 N4 O5 S)

Compound Name

1-(4-methoxybenzenesulfonyl)-4-[3-(4-methoxyphenyl)-1H-pyrazole-5-carbonyl]piperazine

IUPAC name

1-(4-methoxybenzenesulfonyl)-4-[3-(4-methoxyphenyl)-1H-pyrazole-5-carbonyl]piperazine

SMILES

COc(cc1)ccc1-c1n[nH]c(C(N(CC2)CCN2S(c(cc2)ccc2OC)(=O)=O)=O)c1

InChI

InChI=1S/C22H24N4O5S/c1-30-17-5-3-16(4-6-17)20-15-21(24-23-20)22(27)25-11-13-26(14-12-25)32(28,29)19-9-7-18(31-2)8-10-19/h3-10,15H,11-14H2,1-2H3,(H,23,24)

InChI Key

JAOSJPJSBNPCBN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14773183

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

456.52

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.104

Distribution Coefficient, logD

3.103

Water Solubility, LogSw

-3.63

Polar Surface Area

85.983

Acid Dissociation Constant (pKa)

10.31

Base Dissociation Constant (pKb)

0.21

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

References: we are preparing a list of scientific research reports with C590-0164 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C590-0164?
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What is the minimum amount of C590-0164 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C590-0164
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C590-0164
  • 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 C590-0164 available by request