K048-0023 Screening compound: N'-[(E)-(2-hydroxy-3-methoxyphenyl)methylidene]-1-phenyl-5-(trifluoromethyl)-1H-pyrazole-4-carbohydrazide

K048-0023 Screening compound: N'-[(E)-(2-hydroxy-3-methoxyphenyl)methylidene]-1-phenyl-5-(trifluoromethyl)-1H-pyrazole-4-carbohydrazide
K048-0023 Screening compound: N'-[(E)-(2-hydroxy-3-methoxyphenyl)methylidene]-1-phenyl-5-(trifluoromethyl)-1H-pyrazole-4-carbohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound K048-0023
N'-[(E)-(2-hydroxy-3-methoxyphenyl)methylidene]-1-phenyl-5-(trifluoromethyl)-1H-pyrazole-4-carbohydrazide

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

K048-0023

Molecular Formula

C19H15F3N4O3 (C19 H15 F3 N4 O3)

Compound Name

N'-[(E)-(2-hydroxy-3-methoxyphenyl)methylidene]-1-phenyl-5-(trifluoromethyl)-1H-pyrazole-4-carbohydrazide

IUPAC name

N'-[(E)-(2-hydroxy-3-methoxyphenyl)methylidene]-1-phenyl-5-(trifluoromethyl)-1H-pyrazole-4-carbohydrazide

SMILES

COc1cccc(/C=N/NC(c2c(C(F)(F)F)n(-c3ccccc3)nc2)=O)c1O

InChI

InChI=1S/C19H15F3N4O3/c1-29-15-9-5-6-12(16(15)27)10-23-25-18(28)14-11-24-26(17(14)19(20,21)22)13-7-3-2-4-8-13/h2-11,27H,1H3,(H,25,28)

InChI Key

UHURPZHHAJGWDK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01248525

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

404.35

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.799

Distribution Coefficient, logD

3.205

Water Solubility, LogSw

-3.93

Polar Surface Area

71.758

Acid Dissociation Constant (pKa)

6.93

Base Dissociation Constant (pKb)

4.35

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.50

K048-0023 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 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 K048-0023 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K048-0023?
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What is the minimum amount of K048-0023 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K048-0023
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K048-0023
  • 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 K048-0023 available by request