C301-4684 Screening compound: N-[(2-methoxyphenyl)methyl]-4-({[1,2,4]triazolo[4,3-a]quinoxalin-4-yl}amino)benzamide

C301-4684 Screening compound: N-[(2-methoxyphenyl)methyl]-4-({[1,2,4]triazolo[4,3-a]quinoxalin-4-yl}amino)benzamide
C301-4684 Screening compound: N-[(2-methoxyphenyl)methyl]-4-({[1,2,4]triazolo[4,3-a]quinoxalin-4-yl}amino)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C301-4684
N-[(2-methoxyphenyl)methyl]-4-({[1,2,4]triazolo[4,3-a]quinoxalin-4-yl}amino)benzamide

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

C301-4684

Molecular Formula

C24H20N6O2 (C24 H20 N6 O2)

Compound Name

N-[(2-methoxyphenyl)methyl]-4-({[1,2,4]triazolo[4,3-a]quinoxalin-4-yl}amino)benzamide

IUPAC name

N-[(2-methoxyphenyl)methyl]-4-({[124]triazolo[43-a]quinoxalin-4-yl}amino)benzamide

SMILES

COc1c(CNC(c(cc2)ccc2Nc2nc(cccc3)c3n3c2nnc3)=O)cccc1

InChI

InChI=1S/C24H20N6O2/c1-32-21-9-5-2-6-17(21)14-25-24(31)16-10-12-18(13-11-16)27-22-23-29-26-15-30(23)20-8-4-3-7-19(20)28-22/h2-13,15H,14H2,1H3,(H,25,31)(H,27,28)

InChI Key

VFWRDFOVQYMYRR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14743672

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

424.46

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.459

Distribution Coefficient, logD

3.445

Water Solubility, LogSw

-3.64

Polar Surface Area

72.122

Acid Dissociation Constant (pKa)

11.50

Base Dissociation Constant (pKb)

5.93

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.30

C301-4684 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with C301-4684 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C301-4684?
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What is the minimum amount of C301-4684 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C301-4684
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C301-4684
  • 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 C301-4684 available by request