D112-0089 Screening compound: N-(3-chloro-4-methoxyphenyl)-6-(4-methoxyphenyl)pyridazin-3-amine

D112-0089 Screening compound: N-(3-chloro-4-methoxyphenyl)-6-(4-methoxyphenyl)pyridazin-3-amine
D112-0089 Screening compound: N-(3-chloro-4-methoxyphenyl)-6-(4-methoxyphenyl)pyridazin-3-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound D112-0089
N-(3-chloro-4-methoxyphenyl)-6-(4-methoxyphenyl)pyridazin-3-amine

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

D112-0089

Molecular Formula

C18H16ClN3O2 (C18 H16 ClN3 O2)

Compound Name

N-(3-chloro-4-methoxyphenyl)-6-(4-methoxyphenyl)pyridazin-3-amine

IUPAC name

N-(3-chloro-4-methoxyphenyl)-6-(4-methoxyphenyl)pyridazin-3-amine

SMILES

COc(cc1)ccc1-c(cc1)nnc1Nc(cc1)cc(Cl)c1OC

InChI

InChI=1S/C18H16ClN3O2/c1-23-14-6-3-12(4-7-14)16-8-10-18(22-21-16)20-13-5-9-17(24-2)15(19)11-13/h3-11H,1-2H3,(H,20,22)

InChI Key

HWJRLALLPMQXHH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14811921

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

341.8

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.596

Distribution Coefficient, logD

4.596

Water Solubility, LogSw

-4.92

Polar Surface Area

46.364

Acid Dissociation Constant (pKa)

17.30

Base Dissociation Constant (pKb)

3.86

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

D112-0089 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Antiparasite Library (23996 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

Ion Channels Focused Library (26372 compounds)

Receptor-type Protein Tyrosine Phosphatases Library (3746 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Infections
  • Immune system
  • animal
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
  • Nervous system
  • Cardiovascular
  • Cancer
  • Digestive system
  • Nervous system
  • Female
  • Metabolic
  • Endocrine
Mechanism of action:
  • Epigenetic
  • Receptor's ligands
Agro:
  • Agro
Targets:
  • Kinases
  • Ion Channels
  • Phosphatases

References: we are preparing a list of scientific research reports with D112-0089 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D112-0089?
Check Price and Availability of D112-0089, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of D112-0089 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D112-0089
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D112-0089
  • 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 D112-0089 available by request