C301-5831 Screening compound: 1-ethyl-N-[4-(4-methylpiperidin-1-yl)phenyl]-[1,2,4]triazolo[4,3-a]quinoxalin-4-amine

C301-5831 Screening compound: 1-ethyl-N-[4-(4-methylpiperidin-1-yl)phenyl]-[1,2,4]triazolo[4,3-a]quinoxalin-4-amine
C301-5831 Screening compound: 1-ethyl-N-[4-(4-methylpiperidin-1-yl)phenyl]-[1,2,4]triazolo[4,3-a]quinoxalin-4-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound C301-5831
1-ethyl-N-[4-(4-methylpiperidin-1-yl)phenyl]-[1,2,4]triazolo[4,3-a]quinoxalin-4-amine

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

C301-5831

Molecular Formula

C23H26N6 (C23 H26 N6)

Compound Name

1-ethyl-N-[4-(4-methylpiperidin-1-yl)phenyl]-[1,2,4]triazolo[4,3-a]quinoxalin-4-amine

IUPAC name

1-ethyl-N-[4-(4-methylpiperidin-1-yl)phenyl]-[124]triazolo[43-a]quinoxalin-4-amine

SMILES

CCc1nnc2n1c(cccc1)c1nc2Nc(cc1)ccc1N1CCC(C)CC1

InChI

InChI=1S/C23H26N6/c1-3-21-26-27-23-22(25-19-6-4-5-7-20(19)29(21)23)24-17-8-10-18(11-9-17)28-14-12-16(2)13-15-28/h4-11,16H,3,12-15H2,1-2H3,(H,24,25)

InChI Key

NQZVJOFINTXLFN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09696988

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

386.5

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.690

Distribution Coefficient, logD

4.668

Water Solubility, LogSw

-4.22

Polar Surface Area

43.901

Acid Dissociation Constant (pKa)

21.12

Base Dissociation Constant (pKb)

9.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

34.80

References: we are preparing a list of scientific research reports with C301-5831 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C301-5831?
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What is the minimum amount of C301-5831 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C301-5831
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C301-5831
  • 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 C301-5831 available by request