F944-0854 Screening compound: 4-[4-(4-chlorophenyl)-5-acetamido-3-methyl-1H-pyrazol-1-yl]-N-methylbenzamide

F944-0854 Screening compound: 4-[4-(4-chlorophenyl)-5-acetamido-3-methyl-1H-pyrazol-1-yl]-N-methylbenzamide
F944-0854 Screening compound: 4-[4-(4-chlorophenyl)-5-acetamido-3-methyl-1H-pyrazol-1-yl]-N-methylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F944-0854
4-[4-(4-chlorophenyl)-5-acetamido-3-methyl-1H-pyrazol-1-yl]-N-methylbenzamide

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

F944-0854

Molecular Formula

C20H19ClN4O2 (C20 H19 ClN4 O2)

Compound Name

4-[4-(4-chlorophenyl)-5-acetamido-3-methyl-1H-pyrazol-1-yl]-N-methylbenzamide

IUPAC name

4-[4-(4-chlorophenyl)-5-acetamido-3-methyl-1H-pyrazol-1-yl]-N-methylbenzamide

SMILES

CC(Nc(n(-c(cc1)ccc1C(NC)=O)nc1C)c1-c(cc1)ccc1Cl)=O

InChI

InChI=1S/C20H19ClN4O2/c1-12-18(14-4-8-16(21)9-5-14)19(23-13(2)26)25(24-12)17-10-6-15(7-11-17)20(27)22-3/h4-11H,1-3H3,(H,22,27)(H,23,26)

InChI Key

YSCYYFRNGNMVOH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14973394

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

382.85

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.520

Distribution Coefficient, logD

2.520

Water Solubility, LogSw

-3.67

Polar Surface Area

62.154

Acid Dissociation Constant (pKa)

11.87

Base Dissociation Constant (pKb)

-0.81

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.00

F944-0854 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with F944-0854 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F944-0854?
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What is the minimum amount of F944-0854 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F944-0854
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F944-0854
  • 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 F944-0854 available by request