F832-0788 Screening compound: 3-[9-(4-butoxyphenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]-N~1~-[(5-methyl-2-furyl)methyl]propanamide

F832-0788 Screening compound: 3-[9-(4-butoxyphenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]-N~1~-[(5-methyl-2-furyl)methyl]propanamide
F832-0788 Screening compound: 3-[9-(4-butoxyphenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]-N~1~-[(5-methyl-2-furyl)methyl]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F832-0788
3-[9-(4-butoxyphenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]-N~1~-[(5-methyl-2-furyl)methyl]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

F832-0788

Molecular Formula

C26H28N6O3 (C26 H28 N6 O3)

Compound Name

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

IUPAC name

3-[11-(4-butoxyphenyl)-346910-pentaazatricyclo[7.3.0.0^{26}]dodeca-1(12)24710-pentaen-5-yl]-N-[(5-methylfuran-2-yl)methyl]propanamide

SMILES

CCCCOc(cc1)ccc1-c1nn(ccn2c3nnc2CCC(NCc2ccc(C)o2)=O)c3c1

InChI

InChI=1S/C26H28N6O3/c1-3-4-15-34-20-9-6-19(7-10-20)22-16-23-26-29-28-24(31(26)13-14-32(23)30-22)11-12-25(33)27-17-21-8-5-18(2)35-21/h5-10,13-14,16H,3-4,11-12,15,17H2,1-2H3,(H,27,33)

InChI Key

BQTGGXICZIHYCI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27197349

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

472.55

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.715

Distribution Coefficient, logD

3.649

Water Solubility, LogSw

-3.83

Polar Surface Area

72.854

Acid Dissociation Constant (pKa)

12.69

Base Dissociation Constant (pKb)

6.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.80

F832-0788 in Drug Discovery

Included in Screening Libraries

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

Eccentric PPI Library (11937 compounds)

Lipid Metabolism Library (9174 compounds)

Protein-Protein Interaction Library (218420 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 F832-0788 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F832-0788?
Check Price and Availability of F832-0788, 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 F832-0788 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F832-0788
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F832-0788
  • 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 F832-0788 available by request