F670-0087 Screening compound: 3-methyl-1-{3-oxo-3-[4-(2-pyridyl)piperazino]propyl}-2(1H)-quinoxalinone

F670-0087 Screening compound: 3-methyl-1-{3-oxo-3-[4-(2-pyridyl)piperazino]propyl}-2(1H)-quinoxalinone
F670-0087 Screening compound: 3-methyl-1-{3-oxo-3-[4-(2-pyridyl)piperazino]propyl}-2(1H)-quinoxalinone alternative view

Chemical Structure Depiction of ChemDiv screening compound F670-0087
3-methyl-1-{3-oxo-3-[4-(2-pyridyl)piperazino]propyl}-2(1H)-quinoxalinone

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

F670-0087

Molecular Formula

C21H23N5O2 (C21 H23 N5 O2)

Compound Name

3-methyl-1-{3-oxo-3-[4-(2-pyridyl)piperazino]propyl}-2(1H)-quinoxalinone

IUPAC name

3-methyl-1-{3-oxo-3-[4-(pyridin-2-yl)piperazin-1-yl]propyl}-12-dihydroquinoxalin-2-one

SMILES

CC1=Nc(cccc2)c2N(CCC(N(CC2)CCN2c2ncccc2)=O)C1=O

InChI

InChI=1S/C21H23N5O2/c1-16-21(28)26(18-7-3-2-6-17(18)23-16)11-9-20(27)25-14-12-24(13-15-25)19-8-4-5-10-22-19/h2-8,10H,9,11-15H2,1H3

InChI Key

KXLXAWWFLKPGDR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14961878

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

377.45

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.941

Distribution Coefficient, logD

1.932

Water Solubility, LogSw

-1.98

Polar Surface Area

50.765

Acid Dissociation Constant (pKa)

23.63

Base Dissociation Constant (pKb)

5.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.33

F670-0087 in Drug Discovery

Included in Screening Libraries

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

Targeted Diversity Library (40567 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with F670-0087 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F670-0087?
Check Price and Availability of F670-0087, 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 F670-0087 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F670-0087
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F670-0087
  • 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 F670-0087 available by request