E881-0257 Screening compound: ethyl 1-{8-benzoyl-1-methyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl}piperidine-4-carboxylate

E881-0257 Screening compound: ethyl 1-{8-benzoyl-1-methyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl}piperidine-4-carboxylate
E881-0257 Screening compound: ethyl 1-{8-benzoyl-1-methyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl}piperidine-4-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound E881-0257
ethyl 1-{8-benzoyl-1-methyl-[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

E881-0257

Molecular Formula

C25H25N5O3 (C25 H25 N5 O3)

Compound Name

ethyl 1-{8-benzoyl-1-methyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl}piperidine-4-carboxylate

IUPAC name

ethyl 1-{8-benzoyl-1-methyl-[124]triazolo[43-a]quinoxalin-4-yl}piperidine-4-carboxylate

SMILES

CCOC(C(CC1)CCN1c1nc(ccc(C(c2ccccc2)=O)c2)c2n2c1nnc2C)=O

InChI

InChI=1S/C25H25N5O3/c1-3-33-25(32)18-11-13-29(14-12-18)23-24-28-27-16(2)30(24)21-15-19(9-10-20(21)26-23)22(31)17-7-5-4-6-8-17/h4-10,15,18H,3,11-14H2,1-2H3

InChI Key

BOLIVUPSQBDTFB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09696563

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

443.51

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.802

Distribution Coefficient, logD

3.802

Water Solubility, LogSw

-3.85

Polar Surface Area

68.304

Acid Dissociation Constant (pKa)

22.20

Base Dissociation Constant (pKb)

4.27

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

32.00

References: we are preparing a list of scientific research reports with E881-0257 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E881-0257?
Check Price and Availability of E881-0257, 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 E881-0257 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E881-0257
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E881-0257
  • 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 E881-0257 available by request