F832-1047 Screening compound: 3-[9-(4-fluorophenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]-N~1~-[2-(2-thienyl)ethyl]propanamide

F832-1047 Screening compound: 3-[9-(4-fluorophenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]-N~1~-[2-(2-thienyl)ethyl]propanamide
F832-1047 Screening compound: 3-[9-(4-fluorophenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]-N~1~-[2-(2-thienyl)ethyl]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F832-1047
3-[9-(4-fluorophenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]-N~1~-[2-(2-thienyl)ethyl]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

F832-1047

Molecular Formula

C22H19FN6OS (C22 H19 FN6 OS)

Compound Name

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

IUPAC name

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

SMILES

O=C(CCc1nnc(c2c3)n1ccn2nc3-c(cc1)ccc1F)NCCc1cccs1

InChI

InChI=1S/C22H19FN6OS/c23-16-5-3-15(4-6-16)18-14-19-22-26-25-20(28(22)11-12-29(19)27-18)7-8-21(30)24-10-9-17-2-1-13-31-17/h1-6,11-14H,7-10H2,(H,24,30)

InChI Key

ZENSMBOFGJDYOF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27197401

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

434.5

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.988

Distribution Coefficient, logD

1.954

Water Solubility, LogSw

-2.61

Polar Surface Area

59.034

Acid Dissociation Constant (pKa)

14.38

Base Dissociation Constant (pKb)

6.31

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

F832-1047 in Drug Discovery

Included in Screening Libraries

SmartTM Library (51161 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with F832-1047 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F832-1047?
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What is the minimum amount of F832-1047 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F832-1047
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F832-1047
  • 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 F832-1047 available by request