F980-0642 Screening compound: 6-(4-{7-methoxy-1H,4H,5H-benzo[g]indazole-3-carbonyl}piperazin-1-yl)-2-phenyl-2,3-dihydropyridazin-3-one

F980-0642 Screening compound: 6-(4-{7-methoxy-1H,4H,5H-benzo[g]indazole-3-carbonyl}piperazin-1-yl)-2-phenyl-2,3-dihydropyridazin-3-one
F980-0642 Screening compound: 6-(4-{7-methoxy-1H,4H,5H-benzo[g]indazole-3-carbonyl}piperazin-1-yl)-2-phenyl-2,3-dihydropyridazin-3-one alternative view

Chemical Structure Depiction of ChemDiv screening compound F980-0642
6-(4-{7-methoxy-1H,4H,5H-benzo[g]indazole-3-carbonyl}piperazin-1-yl)-2-phenyl-2,3-dihydropyridazin-3-one

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

F980-0642

Molecular Formula

C27H26N6O3 (C27 H26 N6 O3)

Compound Name

6-(4-{7-methoxy-1H,4H,5H-benzo[g]indazole-3-carbonyl}piperazin-1-yl)-2-phenyl-2,3-dihydropyridazin-3-one

IUPAC name

6-(4-{7-methoxy-1H4H5H-benzo[g]indazole-3-carbonyl}piperazin-1-yl)-2-phenyl-23-dihydropyridazin-3-one

SMILES

COc(cc1)cc(CC2)c1-c1c2c(C(N(CC2)CCN2C(C=C2)=NN(c3ccccc3)C2=O)=O)n[nH]1

InChI

InChI=1S/C27H26N6O3/c1-36-20-8-10-21-18(17-20)7-9-22-25(21)28-29-26(22)27(35)32-15-13-31(14-16-32)23-11-12-24(34)33(30-23)19-5-3-2-4-6-19/h2-6,8,10-12,17H,7,9,13-16H2,1H3,(H,28,29)

InChI Key

BPTONYWBTGPPLZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14973766

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

482.54

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.245

Distribution Coefficient, logD

3.245

Water Solubility, LogSw

-3.72

Polar Surface Area

78.747

Acid Dissociation Constant (pKa)

6.65

Base Dissociation Constant (pKb)

1.57

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.90

F980-0642 in Drug Discovery

Included in Screening Libraries

Protein-Protein Interaction Library (218420 compounds)

Chemokine Receptor-Targeted Library (18382 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • Receptor's ligands
Therapeutical areas:
  • Immune system

References: we are preparing a list of scientific research reports with F980-0642 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F980-0642?
Check Price and Availability of F980-0642, 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 F980-0642 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F980-0642
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F980-0642
  • 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 F980-0642 available by request