C301-3584 Screening compound: 2-{4-[(5-bromothiophen-2-yl)sulfonyl]piperazin-1-yl}-3-(3,5-dimethyl-1H-pyrazol-1-yl)quinoxaline

C301-3584 Screening compound: 2-{4-[(5-bromothiophen-2-yl)sulfonyl]piperazin-1-yl}-3-(3,5-dimethyl-1H-pyrazol-1-yl)quinoxaline
C301-3584 Screening compound: 2-{4-[(5-bromothiophen-2-yl)sulfonyl]piperazin-1-yl}-3-(3,5-dimethyl-1H-pyrazol-1-yl)quinoxaline alternative view

Chemical Structure Depiction of ChemDiv screening compound C301-3584
2-{4-[(5-bromothiophen-2-yl)sulfonyl]piperazin-1-yl}-3-(3,5-dimethyl-1H-pyrazol-1-yl)quinoxaline

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

C301-3584

Molecular Formula

C21H21BrN6O2S2 (C21 H21 BrN6 O2 S2)

Compound Name

2-{4-[(5-bromothiophen-2-yl)sulfonyl]piperazin-1-yl}-3-(3,5-dimethyl-1H-pyrazol-1-yl)quinoxaline

IUPAC name

2-{4-[(5-bromothiophen-2-yl)sulfonyl]piperazin-1-yl}-3-(35-dimethyl-1H-pyrazol-1-yl)quinoxaline

SMILES

Cc1cc(C)nn1-c1nc2ccccc2nc1N(CC1)CCN1S(c(s1)ccc1Br)(=O)=O

InChI

InChI=1S/C21H21BrN6O2S2/c1-14-13-15(2)28(25-14)21-20(23-16-5-3-4-6-17(16)24-21)26-9-11-27(12-10-26)32(29,30)19-8-7-18(22)31-19/h3-8,13H,9-12H2,1-2H3

InChI Key

COEFHNNAAOFWHX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14743190

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

533.47

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.420

Distribution Coefficient, logD

4.418

Water Solubility, LogSw

-4.28

Polar Surface Area

66.899

Acid Dissociation Constant (pKa)

24.21

Base Dissociation Constant (pKb)

4.85

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.60

References: we are preparing a list of scientific research reports with C301-3584 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C301-3584?
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What is the minimum amount of C301-3584 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C301-3584
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C301-3584
  • 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 C301-3584 available by request