C786-2624 Screening compound: 2-{2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxoethyl}-9-methoxy-4-methyl-1H,2H-[1,2,4]triazino[4,5-a]indol-1-one

C786-2624 Screening compound: 2-{2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxoethyl}-9-methoxy-4-methyl-1H,2H-[1,2,4]triazino[4,5-a]indol-1-one
C786-2624 Screening compound: 2-{2-[4-(3-chlorophenyl)piperazin-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 C786-2624
2-{2-[4-(3-chlorophenyl)piperazin-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

C786-2624

Molecular Formula

C24H24ClN5O3 (C24 H24 ClN5 O3)

Compound Name

2-{2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxoethyl}-9-methoxy-4-methyl-1H,2H-[1,2,4]triazino[4,5-a]indol-1-one

IUPAC name

2-{2-[4-(3-chlorophenyl)piperazin-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(N(CC2)CCN2c2cccc(Cl)c2)=O)C1=O

InChI

InChI=1S/C24H24ClN5O3/c1-16-26-29(24(32)21-14-19-20(30(16)21)7-4-8-22(19)33-2)15-23(31)28-11-9-27(10-12-28)18-6-3-5-17(25)13-18/h3-8,13-14H,9-12,15H2,1-2H3

InChI Key

XVHCRRKTOOBCIW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14795167

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

465.94

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.221

Distribution Coefficient, logD

3.221

Water Solubility, LogSw

-3.32

Polar Surface Area

56.659

Acid Dissociation Constant (pKa)

19.13

Base Dissociation Constant (pKb)

2.69

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.20

C786-2624 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C786-2624 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C786-2624?
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What is the minimum amount of C786-2624 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C786-2624
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C786-2624
  • 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 C786-2624 available by request