D118-0070 Screening compound: methyl 3-(4-methoxyphenoxy)-5,6-diphenylpyridazine-4-carboxylate

D118-0070 Screening compound: methyl 3-(4-methoxyphenoxy)-5,6-diphenylpyridazine-4-carboxylate
D118-0070 Screening compound: methyl 3-(4-methoxyphenoxy)-5,6-diphenylpyridazine-4-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound D118-0070
methyl 3-(4-methoxyphenoxy)-5,6-diphenylpyridazine-4-carboxylate

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

D118-0070

Molecular Formula

C25H20N2O4 (C25 H20 N2 O4)

Compound Name

methyl 3-(4-methoxyphenoxy)-5,6-diphenylpyridazine-4-carboxylate

IUPAC name

methyl 3-(4-methoxyphenoxy)-56-diphenylpyridazine-4-carboxylate

SMILES

COC(c(c(-c1ccccc1)c(-c1ccccc1)nn1)c1Oc(cc1)ccc1OC)=O

InChI

InChI=1S/C25H20N2O4/c1-29-19-13-15-20(16-14-19)31-24-22(25(28)30-2)21(17-9-5-3-6-10-17)23(26-27-24)18-11-7-4-8-12-18/h3-16H,1-2H3

InChI Key

TXFKLYJLWBTDQC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06640412

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

412.44

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.231

Distribution Coefficient, logD

5.231

Water Solubility, LogSw

-5.36

Polar Surface Area

58.432

Acid Dissociation Constant (pKa)

32.91

Base Dissociation Constant (pKb)

1.60

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.00

D118-0070 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Antiviral Library (67538 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with D118-0070 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D118-0070?
Check Price and Availability of D118-0070, 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 D118-0070 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D118-0070
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D118-0070
  • 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 D118-0070 available by request