C850-0548 Screening compound: N1,N1-diethyl-3-methyl-N4-{[1,2,3,4]tetrazolo[1,5-a]quinoxalin-4-yl}benzene-1,4-diamine

C850-0548 Screening compound: N1,N1-diethyl-3-methyl-N4-{[1,2,3,4]tetrazolo[1,5-a]quinoxalin-4-yl}benzene-1,4-diamine
C850-0548 Screening compound: N1,N1-diethyl-3-methyl-N4-{[1,2,3,4]tetrazolo[1,5-a]quinoxalin-4-yl}benzene-1,4-diamine alternative view

Chemical Structure Depiction of ChemDiv screening compound C850-0548
N1,N1-diethyl-3-methyl-N4-{[1,2,3,4]tetrazolo[1,5-a]quinoxalin-4-yl}benzene-1,4-diamine

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

C850-0548

Molecular Formula

C19H21N7 (C19 H21 N7)

Compound Name

N1,N1-diethyl-3-methyl-N4-{[1,2,3,4]tetrazolo[1,5-a]quinoxalin-4-yl}benzene-1,4-diamine

IUPAC name

N1N1-diethyl-3-methyl-N4-{[1234]tetrazolo[15-a]quinoxalin-4-yl}benzene-14-diamine

SMILES

CCN(CC)c(cc1)cc(C)c1Nc1nc(cccc2)c2n2nnnc12

InChI

InChI=1S/C19H21N7/c1-4-25(5-2)14-10-11-15(13(3)12-14)20-18-19-22-23-24-26(19)17-9-7-6-8-16(17)21-18/h6-12H,4-5H2,1-3H3,(H,20,21)

InChI Key

LLUMVVUIUFDRIR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14800539

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

347.42

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.858

Distribution Coefficient, logD

3.602

Water Solubility, LogSw

-3.91

Polar Surface Area

56.415

Acid Dissociation Constant (pKa)

19.04

Base Dissociation Constant (pKb)

7.30

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.30

References: we are preparing a list of scientific research reports with C850-0548 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C850-0548?
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What is the minimum amount of C850-0548 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C850-0548
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C850-0548
  • 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 C850-0548 available by request