C798-0197 Screening compound: N-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-8-methyl-2-[(4-methylphenyl)methyl]-2H,4H,5H-furo[2,3-g]indazole-7-carboxamide

C798-0197 Screening compound: N-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-8-methyl-2-[(4-methylphenyl)methyl]-2H,4H,5H-furo[2,3-g]indazole-7-carboxamide
C798-0197 Screening compound: N-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-8-methyl-2-[(4-methylphenyl)methyl]-2H,4H,5H-furo[2,3-g]indazole-7-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C798-0197
N-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-8-methyl-2-[(4-methylphenyl)methyl]-2H,4H,5H-furo[2,3-g]indazole-7-carboxamide

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

C798-0197

Molecular Formula

C32H36FN5O2 (C32 H36 FN5 O2)

Compound Name

N-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-8-methyl-2-[(4-methylphenyl)methyl]-2H,4H,5H-furo[2,3-g]indazole-7-carboxamide

IUPAC name

N-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-8-methyl-2-[(4-methylphenyl)methyl]-2H4H5H-furo[23-g]indazole-7-carboxamide

SMILES

Cc1c(C(NCCCN(CC2)CCN2c(cc2)ccc2F)=O)oc2c1-c1nn(Cc3ccc(C)cc3)cc1CC2

InChI

InChI=1S/C32H36FN5O2/c1-22-4-6-24(7-5-22)20-38-21-25-8-13-28-29(30(25)35-38)23(2)31(40-28)32(39)34-14-3-15-36-16-18-37(19-17-36)27-11-9-26(33)10-12-27/h4-7,9-12,21H,3,8,13-20H2,1-2H3,(H,34,39)

InChI Key

UDKPUJXXIZDBJJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14798929

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

541.67

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.742

Distribution Coefficient, logD

4.199

Water Solubility, LogSw

-4.35

Polar Surface Area

55.334

Acid Dissociation Constant (pKa)

14.79

Base Dissociation Constant (pKb)

7.80

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.50

C798-0197 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 C798-0197 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C798-0197?
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What is the minimum amount of C798-0197 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C798-0197
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C798-0197
  • 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 C798-0197 available by request