8016-3844 Screening compound: 3-chloro-N~1~-[1-(3-fluorophenyl)-3-methyl-1H-pyrazol-5-yl]benzamide

8016-3844 Screening compound: 3-chloro-N~1~-[1-(3-fluorophenyl)-3-methyl-1H-pyrazol-5-yl]benzamide
8016-3844 Screening compound: 3-chloro-N~1~-[1-(3-fluorophenyl)-3-methyl-1H-pyrazol-5-yl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8016-3844
3-chloro-N~1~-[1-(3-fluorophenyl)-3-methyl-1H-pyrazol-5-yl]benzamide

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

8016-3844

Molecular Formula

C17H13ClFN3O (C17 H13 ClFN3 O)

Compound Name

3-chloro-N~1~-[1-(3-fluorophenyl)-3-methyl-1H-pyrazol-5-yl]benzamide

IUPAC name

3-chloro-N-[1-(3-fluorophenyl)-3-methyl-1H-pyrazol-5-yl]benzamide

SMILES

Cc(cc1NC(c2cccc(Cl)c2)=O)nn1-c1cc(F)ccc1

InChI

InChI=1S/C17H13ClFN3O/c1-11-8-16(20-17(23)12-4-2-5-13(18)9-12)22(21-11)15-7-3-6-14(19)10-15/h2-10H,1H3,(H,20,23)

InChI Key

CDLMDYZBRPRCHN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05855958

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

329.76

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.905

Distribution Coefficient, logD

3.682

Water Solubility, LogSw

-4.30

Polar Surface Area

37.571

Acid Dissociation Constant (pKa)

7.57

Base Dissociation Constant (pKb)

-2.86

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.88

8016-3844 in Drug Discovery

Included in Screening Libraries

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 8016-3844 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8016-3844?
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What is the minimum amount of 8016-3844 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8016-3844
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8016-3844
  • 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 8016-3844 available by request