8003-3821 Screening compound: 4-({[(4E)-1-(3-chlorophenyl)-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-4-ylidene]methyl}amino)-N-(2-methoxyphenyl)benzene-1-sulfonamide

8003-3821 Screening compound: 4-({[(4E)-1-(3-chlorophenyl)-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-4-ylidene]methyl}amino)-N-(2-methoxyphenyl)benzene-1-sulfonamide
8003-3821 Screening compound: 4-({[(4E)-1-(3-chlorophenyl)-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-4-ylidene]methyl}amino)-N-(2-methoxyphenyl)benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8003-3821
4-({[(4E)-1-(3-chlorophenyl)-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-4-ylidene]methyl}amino)-N-(2-methoxyphenyl)benzene-1-sulfonamide

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

8003-3821

Molecular Formula

C24H21ClN4O4S (C24 H21 ClN4 O4 S)

Compound Name

4-({[(4E)-1-(3-chlorophenyl)-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-4-ylidene]methyl}amino)-N-(2-methoxyphenyl)benzene-1-sulfonamide

IUPAC name

4-({[(4E)-1-(3-chlorophenyl)-3-methyl-5-oxo-45-dihydro-1H-pyrazol-4-ylidene]methyl}amino)-N-(2-methoxyphenyl)benzene-1-sulfonamide

SMILES

CC(/C(/C1=O)=C\Nc(cc2)ccc2S(Nc(cccc2)c2OC)(=O)=O)=NN1c1cccc(Cl)c1

InChI

InChI=1S/C24H21ClN4O4S/c1-16-21(24(30)29(27-16)19-7-5-6-17(25)14-19)15-26-18-10-12-20(13-11-18)34(31,32)28-22-8-3-4-9-23(22)33-2/h3-15,26,28H,1-2H3

InChI Key

OAFMXHUAGSTPNU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00697453

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

496.97

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.458

Distribution Coefficient, logD

4.398

Water Solubility, LogSw

-4.51

Polar Surface Area

84.770

Acid Dissociation Constant (pKa)

8.23

Base Dissociation Constant (pKb)

3.35

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.30

References: we are preparing a list of scientific research reports with 8003-3821 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8003-3821?
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What is the minimum amount of 8003-3821 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8003-3821
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8003-3821
  • 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 8003-3821 available by request