C786-2615 Screening compound: 2-[2-(azepan-1-yl)-2-oxoethyl]-9-methoxy-4-methyl-1H,2H-[1,2,4]triazino[4,5-a]indol-1-one

C786-2615 Screening compound: 2-[2-(azepan-1-yl)-2-oxoethyl]-9-methoxy-4-methyl-1H,2H-[1,2,4]triazino[4,5-a]indol-1-one
C786-2615 Screening compound: 2-[2-(azepan-1-yl)-2-oxoethyl]-9-methoxy-4-methyl-1H,2H-[1,2,4]triazino[4,5-a]indol-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound C786-2615
2-[2-(azepan-1-yl)-2-oxoethyl]-9-methoxy-4-methyl-1H,2H-[1,2,4]triazino[4,5-a]indol-1-one

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

C786-2615

Molecular Formula

C20H24N4O3 (C20 H24 N4 O3)

Compound Name

2-[2-(azepan-1-yl)-2-oxoethyl]-9-methoxy-4-methyl-1H,2H-[1,2,4]triazino[4,5-a]indol-1-one

IUPAC name

2-[2-(azepan-1-yl)-2-oxoethyl]-9-methoxy-4-methyl-1H2H-[124]triazino[45-a]indol-1-one

SMILES

CC(n(c1c2)c3c2c(OC)ccc3)=NN(CC(N2CCCCCC2)=O)C1=O

InChI

InChI=1S/C20H24N4O3/c1-14-21-23(13-19(25)22-10-5-3-4-6-11-22)20(26)17-12-15-16(24(14)17)8-7-9-18(15)27-2/h7-9,12H,3-6,10-11,13H2,1-2H3

InChI Key

QJMJXSPSLBYPLG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14795161

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

368.44

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.498

Distribution Coefficient, logD

2.498

Water Solubility, LogSw

-2.61

Polar Surface Area

53.730

Acid Dissociation Constant (pKa)

19.13

Base Dissociation Constant (pKb)

2.69

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

45.00

C786-2615 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

CNS Annotated Library (688 compounds)

Voltage-Gated Ion Channel-Targeted Library (4740 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Nervous system
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Targets:
  • Ion Channels
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with C786-2615 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C786-2615?
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What is the minimum amount of C786-2615 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C786-2615
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C786-2615
  • 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 C786-2615 available by request