3232-1204 Screening compound: (4E)-4-[(3-bromo-4-methoxyphenyl)methylidene]-3-methyl-1-phenyl-4,5-dihydro-1H-pyrazol-5-one

3232-1204 Screening compound: (4E)-4-[(3-bromo-4-methoxyphenyl)methylidene]-3-methyl-1-phenyl-4,5-dihydro-1H-pyrazol-5-one
3232-1204 Screening compound: (4E)-4-[(3-bromo-4-methoxyphenyl)methylidene]-3-methyl-1-phenyl-4,5-dihydro-1H-pyrazol-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 3232-1204
(4E)-4-[(3-bromo-4-methoxyphenyl)methylidene]-3-methyl-1-phenyl-4,5-dihydro-1H-pyrazol-5-one

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

3232-1204

Molecular Formula

C18H15BrN2O2 (C18 H15 BrN2 O2)

Compound Name

(4E)-4-[(3-bromo-4-methoxyphenyl)methylidene]-3-methyl-1-phenyl-4,5-dihydro-1H-pyrazol-5-one

IUPAC name

(4E)-4-[(3-bromo-4-methoxyphenyl)methylidene]-3-methyl-1-phenyl-45-dihydro-1H-pyrazol-5-one

SMILES

CC(/C(/C1=O)=C\c(cc2)cc(Br)c2OC)=NN1c1ccccc1

InChI

InChI=1S/C18H15BrN2O2/c1-12-15(10-13-8-9-17(23-2)16(19)11-13)18(22)21(20-12)14-6-4-3-5-7-14/h3-11H,1-2H3

InChI Key

UGDBBQKBNABSRQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00850797

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

371.23

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.821

Distribution Coefficient, logD

3.821

Water Solubility, LogSw

-4.07

Polar Surface Area

33.217

Acid Dissociation Constant (pKa)

27.50

Base Dissociation Constant (pKb)

2.92

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

3232-1204 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

Human Kinases Annotated Library (2415 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 3232-1204 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3232-1204?
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What is the minimum amount of 3232-1204 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3232-1204
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3232-1204
  • 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 3232-1204 available by request