E881-0215 Screening compound: 2-({8-benzoyl-1-methyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl}amino)phenol

E881-0215 Screening compound: 2-({8-benzoyl-1-methyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl}amino)phenol
E881-0215 Screening compound: 2-({8-benzoyl-1-methyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl}amino)phenol alternative view

Chemical Structure Depiction of ChemDiv screening compound E881-0215
2-({8-benzoyl-1-methyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl}amino)phenol

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

E881-0215

Molecular Formula

C23H17N5O2 (C23 H17 N5 O2)

Compound Name

2-({8-benzoyl-1-methyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl}amino)phenol

IUPAC name

2-({8-benzoyl-1-methyl-[124]triazolo[43-a]quinoxalin-4-yl}amino)phenol

SMILES

Cc1nnc2n1c(cc(cc1)C(c3ccccc3)=O)c1nc2Nc(cccc1)c1O

InChI

InChI=1S/C23H17N5O2/c1-14-26-27-23-22(25-18-9-5-6-10-20(18)29)24-17-12-11-16(13-19(17)28(14)23)21(30)15-7-3-2-4-8-15/h2-13,29H,1H3,(H,24,25)

InChI Key

LEXZJQMCWAMMPL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09696546

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

395.42

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.032

Distribution Coefficient, logD

4.032

Water Solubility, LogSw

-3.73

Polar Surface Area

69.567

Acid Dissociation Constant (pKa)

10.49

Base Dissociation Constant (pKb)

3.27

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.30

E881-0215 in Drug Discovery

Included in Screening Libraries

Purinergic Library (3321 compounds)

Carbonic Anhydrase II Library (4939 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 E881-0215 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E881-0215?
Check Price and Availability of E881-0215, 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 E881-0215 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E881-0215
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E881-0215
  • 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 E881-0215 available by request