F833-0458 Screening compound: 2-[9-(4-fluorophenyl)-3-oxopyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-2(3H)-yl]-N~1~-(4-methoxyphenyl)acetamide

F833-0458 Screening compound: 2-[9-(4-fluorophenyl)-3-oxopyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-2(3H)-yl]-N~1~-(4-methoxyphenyl)acetamide
F833-0458 Screening compound: 2-[9-(4-fluorophenyl)-3-oxopyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-2(3H)-yl]-N~1~-(4-methoxyphenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F833-0458
2-[9-(4-fluorophenyl)-3-oxopyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-2(3H)-yl]-N~1~-(4-methoxyphenyl)acetamide

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

F833-0458

Molecular Formula

C22H17FN6O3 (C22 H17 FN6 O3)

Compound Name

2-[9-(4-fluorophenyl)-3-oxopyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-2(3H)-yl]-N~1~-(4-methoxyphenyl)acetamide

IUPAC name

2-[11-(4-fluorophenyl)-5-oxo-346910-pentaazatricyclo[7.3.0.0^{26}]dodeca-1(12)2710-tetraen-4-yl]-N-(4-methoxyphenyl)acetamide

SMILES

COc(cc1)ccc1NC(CN1N=C(c2cc(-c(cc3)ccc3F)nn2C=C2)N2C1=O)=O

InChI

InChI=1S/C22H17FN6O3/c1-32-17-8-6-16(7-9-17)24-20(30)13-29-22(31)27-10-11-28-19(21(27)26-29)12-18(25-28)14-2-4-15(23)5-3-14/h2-12H,13H2,1H3,(H,24,30)

InChI Key

AXRMRQCKEXNRKY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27197510

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

432.41

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.790

Distribution Coefficient, logD

2.790

Water Solubility, LogSw

-3.45

Polar Surface Area

74.012

Acid Dissociation Constant (pKa)

13.01

Base Dissociation Constant (pKb)

4.17

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.10

References: we are preparing a list of scientific research reports with F833-0458 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F833-0458?
Check Price and Availability of F833-0458, 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 F833-0458 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F833-0458
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F833-0458
  • 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 F833-0458 available by request