T226-1258 Screening compound: 5-ethyl-7-[4-(2-fluorophenyl)piperazine-1-carbonyl]-4H,5H-pyrazolo[1,5-a]quinoxalin-4-one

T226-1258 Screening compound: 5-ethyl-7-[4-(2-fluorophenyl)piperazine-1-carbonyl]-4H,5H-pyrazolo[1,5-a]quinoxalin-4-one
T226-1258 Screening compound: 5-ethyl-7-[4-(2-fluorophenyl)piperazine-1-carbonyl]-4H,5H-pyrazolo[1,5-a]quinoxalin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound T226-1258
5-ethyl-7-[4-(2-fluorophenyl)piperazine-1-carbonyl]-4H,5H-pyrazolo[1,5-a]quinoxalin-4-one

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

T226-1258

Molecular Formula

C23H22FN5O2 (C23 H22 FN5 O2)

Compound Name

5-ethyl-7-[4-(2-fluorophenyl)piperazine-1-carbonyl]-4H,5H-pyrazolo[1,5-a]quinoxalin-4-one

IUPAC name

5-ethyl-7-[4-(2-fluorophenyl)piperazine-1-carbonyl]-4H5H-pyrazolo[15-a]quinoxalin-4-one

SMILES

CCN(c(cc(cc1)C(N(CC2)CCN2c(cccc2)c2F)=O)c1-n1nccc11)C1=O

InChI

InChI=1S/C23H22FN5O2/c1-2-28-21-15-16(7-8-19(21)29-20(23(28)31)9-10-25-29)22(30)27-13-11-26(12-14-27)18-6-4-3-5-17(18)24/h3-10,15H,2,11-14H2,1H3

InChI Key

WHISPLJTBTXTSE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29025663

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

419.46

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.400

Distribution Coefficient, logD

2.400

Water Solubility, LogSw

-2.72

Polar Surface Area

47.443

Acid Dissociation Constant (pKa)

26.88

Base Dissociation Constant (pKb)

0.66

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.10

T226-1258 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with T226-1258 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T226-1258?
Check Price and Availability of T226-1258, 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 T226-1258 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T226-1258
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T226-1258
  • 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 T226-1258 available by request