F548-2100 Screening compound: N-(2H-1,3-benzodioxol-5-yl)-6-(2,3-dihydro-1H-indole-1-carbonyl)pyridazin-3-amine

F548-2100 Screening compound: N-(2H-1,3-benzodioxol-5-yl)-6-(2,3-dihydro-1H-indole-1-carbonyl)pyridazin-3-amine
F548-2100 Screening compound: N-(2H-1,3-benzodioxol-5-yl)-6-(2,3-dihydro-1H-indole-1-carbonyl)pyridazin-3-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound F548-2100
N-(2H-1,3-benzodioxol-5-yl)-6-(2,3-dihydro-1H-indole-1-carbonyl)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

F548-2100

Molecular Formula

C20H16N4O3 (C20 H16 N4 O3)

Compound Name

N-(2H-1,3-benzodioxol-5-yl)-6-(2,3-dihydro-1H-indole-1-carbonyl)pyridazin-3-amine

IUPAC name

N-(2H-13-benzodioxol-5-yl)-6-(23-dihydro-1H-indole-1-carbonyl)pyridazin-3-amine

SMILES

O=C(c(cc1)nnc1Nc(cc1)cc2c1OCO2)N(CC1)c2c1cccc2

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

360.37

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.271

Distribution Coefficient, logD

3.271

Water Solubility, LogSw

-3.40

Polar Surface Area

64.255

Acid Dissociation Constant (pKa)

15.82

Base Dissociation Constant (pKb)

1.78

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.00

F548-2100 in Drug Discovery

Included in Screening Libraries

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

Protein Kinases Inhibitors Library (36801 compounds)

Targeted Diversity Library (40567 compounds)

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases
Mechanism of action:
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with F548-2100 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F548-2100?
Check Price and Availability of F548-2100, 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 F548-2100 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F548-2100
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F548-2100
  • 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 F548-2100 available by request