F832-1038 Screening compound: 3-[9-(4-butoxyphenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]-N~1~-(4-fluorobenzyl)propanamide

F832-1038 Screening compound: 3-[9-(4-butoxyphenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]-N~1~-(4-fluorobenzyl)propanamide
F832-1038 Screening compound: 3-[9-(4-butoxyphenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]-N~1~-(4-fluorobenzyl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F832-1038
3-[9-(4-butoxyphenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]-N~1~-(4-fluorobenzyl)propanamide

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

F832-1038

Molecular Formula

C27H27FN6O2 (C27 H27 FN6 O2)

Compound Name

3-[9-(4-butoxyphenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]-N~1~-(4-fluorobenzyl)propanamide

IUPAC name

3-[11-(4-butoxyphenyl)-346910-pentaazatricyclo[7.3.0.0^{26}]dodeca-1(12)24710-pentaen-5-yl]-N-[(4-fluorophenyl)methyl]propanamide

SMILES

CCCCOc(cc1)ccc1-c1nn(ccn2c3nnc2CCC(NCc(cc2)ccc2F)=O)c3c1

InChI

InChI=1S/C27H27FN6O2/c1-2-3-16-36-22-10-6-20(7-11-22)23-17-24-27-31-30-25(33(27)14-15-34(24)32-23)12-13-26(35)29-18-19-4-8-21(28)9-5-19/h4-11,14-15,17H,2-3,12-13,16,18H2,1H3,(H,29,35)

InChI Key

KMURAWTXUGSHIK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27197395

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

486.55

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.687

Distribution Coefficient, logD

3.620

Water Solubility, LogSw

-3.82

Polar Surface Area

65.592

Acid Dissociation Constant (pKa)

12.45

Base Dissociation Constant (pKb)

6.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.90

F832-1038 in Drug Discovery

Included in Screening Libraries

Eccentric PPI Library (11937 compounds)

Lipid Metabolism Library (9174 compounds)

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds
Therapeutical areas:
  • Cardiovascular
  • Metabolic

References: we are preparing a list of scientific research reports with F832-1038 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F832-1038?
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What is the minimum amount of F832-1038 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F832-1038
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F832-1038
  • 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 F832-1038 available by request