8016-9835 Screening compound: 4-chloro-5-[4-(3,4-dichlorobenzoyl)piperazino]-2-phenyl-3(2H)-pyridazinone

8016-9835 Screening compound: 4-chloro-5-[4-(3,4-dichlorobenzoyl)piperazino]-2-phenyl-3(2H)-pyridazinone
8016-9835 Screening compound: 4-chloro-5-[4-(3,4-dichlorobenzoyl)piperazino]-2-phenyl-3(2H)-pyridazinone alternative view

Chemical Structure Depiction of ChemDiv screening compound 8016-9835
4-chloro-5-[4-(3,4-dichlorobenzoyl)piperazino]-2-phenyl-3(2H)-pyridazinone

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

8016-9835

Molecular Formula

C21H17Cl3N4O2 (C21 H17 Cl3 N4 O2)

Compound Name

4-chloro-5-[4-(3,4-dichlorobenzoyl)piperazino]-2-phenyl-3(2H)-pyridazinone

IUPAC name

4-chloro-5-[4-(34-dichlorobenzoyl)piperazin-1-yl]-2-phenyl-23-dihydropyridazin-3-one

SMILES

O=C(c(cc1)cc(Cl)c1Cl)N(CC1)CCN1C(C=NN(c1ccccc1)C1=O)=C1Cl

InChI

InChI=1S/C21H17Cl3N4O2/c22-16-7-6-14(12-17(16)23)20(29)27-10-8-26(9-11-27)18-13-25-28(21(30)19(18)24)15-4-2-1-3-5-15/h1-7,12-13H,8-11H2

InChI Key

ZBFLTSIXADYJNT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05860807

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

463.75

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.029

Distribution Coefficient, logD

4.029

Water Solubility, LogSw

-4.46

Polar Surface Area

47.444

Acid Dissociation Constant (pKa)

28.72

Base Dissociation Constant (pKb)

0.40

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.05

References: we are preparing a list of scientific research reports with 8016-9835 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8016-9835?
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What is the minimum amount of 8016-9835 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8016-9835
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8016-9835
  • 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 8016-9835 available by request