E869-0224 Screening compound: ethyl 1-{1-ethyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl}piperidine-4-carboxylate

E869-0224 Screening compound: ethyl 1-{1-ethyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl}piperidine-4-carboxylate
E869-0224 Screening compound: ethyl 1-{1-ethyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl}piperidine-4-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound E869-0224
ethyl 1-{1-ethyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl}piperidine-4-carboxylate

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

E869-0224

Molecular Formula

C19H23N5O2 (C19 H23 N5 O2)

Compound Name

ethyl 1-{1-ethyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl}piperidine-4-carboxylate

IUPAC name

ethyl 1-{1-ethyl-[124]triazolo[43-a]quinoxalin-4-yl}piperidine-4-carboxylate

SMILES

CCc1nnc2n1c(cccc1)c1nc2N(CC1)CCC1C(OCC)=O

InChI

InChI=1S/C19H23N5O2/c1-3-16-21-22-18-17(20-14-7-5-6-8-15(14)24(16)18)23-11-9-13(10-12-23)19(25)26-4-2/h5-8,13H,3-4,9-12H2,1-2H3

InChI Key

YSMFGVVSGXEEOF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09696969

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

353.42

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

3.100

Distribution Coefficient, logD

3.098

Water Solubility, LogSw

-2.88

Polar Surface Area

55.036

Acid Dissociation Constant (pKa)

22.20

Base Dissociation Constant (pKb)

5.11

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

47.40

E869-0224 in Drug Discovery

Included in Screening Libraries

Purinergic Library (3321 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cardiovascular
  • Metabolic
Targets:
  • GPCR
  • Ion Channels
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with E869-0224 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E869-0224?
Check Price and Availability of E869-0224, 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 E869-0224 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E869-0224
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E869-0224
  • 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 E869-0224 available by request