8016-5422 Screening compound: 3-(4-fluorophenyl)-1H-pyrazole-4-carbaldehyde 4-(3,5-dichloro-2-pyridyl)hydrazone

8016-5422 Screening compound: 3-(4-fluorophenyl)-1H-pyrazole-4-carbaldehyde 4-(3,5-dichloro-2-pyridyl)hydrazone
8016-5422 Screening compound: 3-(4-fluorophenyl)-1H-pyrazole-4-carbaldehyde 4-(3,5-dichloro-2-pyridyl)hydrazone alternative view

Chemical Structure Depiction of ChemDiv screening compound 8016-5422
3-(4-fluorophenyl)-1H-pyrazole-4-carbaldehyde 4-(3,5-dichloro-2-pyridyl)hydrazone

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

8016-5422

Molecular Formula

C15H10Cl2FN5 (C15 H10 Cl2 FN5)

Compound Name

3-(4-fluorophenyl)-1H-pyrazole-4-carbaldehyde 4-(3,5-dichloro-2-pyridyl)hydrazone

IUPAC name

35-dichloro-2-[(2Z)-2-{[3-(4-fluorophenyl)-1H-pyrazol-4-yl]methylidene}hydrazin-1-yl]pyridine

SMILES

Fc(cc1)ccc1-c1n[nH]cc1/C=N\Nc(ncc(Cl)c1)c1Cl

InChI

InChI=1S/C15H10Cl2FN5/c16-11-5-13(17)15(19-8-11)23-21-7-10-6-20-22-14(10)9-1-3-12(18)4-2-9/h1-8H,(H,19,23)(H,20,22)

InChI Key

VWLDSTQHQVWIGI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05857198

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

350.18

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.200

Distribution Coefficient, logD

4.199

Water Solubility, LogSw

-4.53

Polar Surface Area

55.343

Acid Dissociation Constant (pKa)

11.00

Base Dissociation Constant (pKb)

2.25

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

8016-5422 in Drug Discovery

Included in Screening Libraries

Chelators targeting matrix metalloproteinases library (8930 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Cardiovascular
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with 8016-5422 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8016-5422?
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What is the minimum amount of 8016-5422 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8016-5422
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8016-5422
  • 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 8016-5422 available by request