C850-0521 Screening compound: ethyl 4-({[1,2,3,4]tetrazolo[1,5-a]quinoxalin-4-yl}amino)benzoate

C850-0521 Screening compound: ethyl 4-({[1,2,3,4]tetrazolo[1,5-a]quinoxalin-4-yl}amino)benzoate
C850-0521 Screening compound: ethyl 4-({[1,2,3,4]tetrazolo[1,5-a]quinoxalin-4-yl}amino)benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound C850-0521
ethyl 4-({[1,2,3,4]tetrazolo[1,5-a]quinoxalin-4-yl}amino)benzoate

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

C850-0521

Molecular Formula

C17H14N6O2 (C17 H14 N6 O2)

Compound Name

ethyl 4-({[1,2,3,4]tetrazolo[1,5-a]quinoxalin-4-yl}amino)benzoate

IUPAC name

ethyl 4-({[1234]tetrazolo[15-a]quinoxalin-4-yl}amino)benzoate

SMILES

CCOC(c(cc1)ccc1Nc1nc(cccc2)c2n2nnnc12)=O

InChI

InChI=1S/C17H14N6O2/c1-2-25-17(24)11-7-9-12(10-8-11)18-15-16-20-21-22-23(16)14-6-4-3-5-13(14)19-15/h3-10H,2H2,1H3,(H,18,19)

InChI Key

NPNJMTIWTRAMPR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06752114

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

334.34

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.365

Distribution Coefficient, logD

3.363

Water Solubility, LogSw

-3.46

Polar Surface Area

75.131

Acid Dissociation Constant (pKa)

17.76

Base Dissociation Constant (pKb)

5.16

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.80

References: we are preparing a list of scientific research reports with C850-0521 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C850-0521?
Check Price and Availability of C850-0521, 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 C850-0521 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C850-0521
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C850-0521
  • 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 C850-0521 available by request