2367-1331 Screening compound: (4E)-1-(3-chlorophenyl)-3-methyl-4-[(3-phenyl-1H-pyrazol-4-yl)methylidene]-4,5-dihydro-1H-pyrazol-5-one

2367-1331 Screening compound: (4E)-1-(3-chlorophenyl)-3-methyl-4-[(3-phenyl-1H-pyrazol-4-yl)methylidene]-4,5-dihydro-1H-pyrazol-5-one
2367-1331 Screening compound: (4E)-1-(3-chlorophenyl)-3-methyl-4-[(3-phenyl-1H-pyrazol-4-yl)methylidene]-4,5-dihydro-1H-pyrazol-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 2367-1331
(4E)-1-(3-chlorophenyl)-3-methyl-4-[(3-phenyl-1H-pyrazol-4-yl)methylidene]-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

2367-1331

Molecular Formula

C20H15ClN4O (C20 H15 ClN4 O)

Compound Name

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

IUPAC name

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

SMILES

CC(/C(/C1=O)=C\c2c[nH]nc2-c2ccccc2)=NN1c1cccc(Cl)c1

InChI

InChI=1S/C20H15ClN4O/c1-13-18(20(26)25(24-13)17-9-5-8-16(21)11-17)10-15-12-22-23-19(15)14-6-3-2-4-7-14/h2-12H,1H3,(H,22,23)

InChI Key

XXICKNQYJKLJSE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01359684

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

362.82

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.074

Distribution Coefficient, logD

4.074

Water Solubility, LogSw

-4.38

Polar Surface Area

49.777

Acid Dissociation Constant (pKa)

13.40

Base Dissociation Constant (pKb)

1.88

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.00

References: we are preparing a list of scientific research reports with 2367-1331 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2367-1331?
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What is the minimum amount of 2367-1331 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2367-1331
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2367-1331
  • 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 2367-1331 available by request