E717-0724 Screening compound: 3-(2-{[1,4'-bipiperidin]-1'-yl}-2-oxoethyl)-3H,4H,5H-pyridazino[4,5-b]indol-4-one

E717-0724 Screening compound: 3-(2-{[1,4'-bipiperidin]-1'-yl}-2-oxoethyl)-3H,4H,5H-pyridazino[4,5-b]indol-4-one
E717-0724 Screening compound: 3-(2-{[1,4'-bipiperidin]-1'-yl}-2-oxoethyl)-3H,4H,5H-pyridazino[4,5-b]indol-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound E717-0724
3-(2-{[1,4'-bipiperidin]-1'-yl}-2-oxoethyl)-3H,4H,5H-pyridazino[4,5-b]indol-4-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

E717-0724

Molecular Formula

C22H27N5O2 (C22 H27 N5 O2)

Compound Name

3-(2-{[1,4'-bipiperidin]-1'-yl}-2-oxoethyl)-3H,4H,5H-pyridazino[4,5-b]indol-4-one

IUPAC name

3-(2-{[14'-bipiperidin]-1'-yl}-2-oxoethyl)-3H4H5H-pyridazino[45-b]indol-4-one

SMILES

O=C(CN(C1=O)N=Cc2c1[nH]c1c2cccc1)N(CC1)CCC1N1CCCCC1

InChI

InChI=1S/C22H27N5O2/c28-20(26-12-8-16(9-13-26)25-10-4-1-5-11-25)15-27-22(29)21-18(14-23-27)17-6-2-3-7-19(17)24-21/h2-3,6-7,14,16,24H,1,4-5,8-13,15H2

InChI Key

GVJVWWONSGEFLU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14912408

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

393.49

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.555

Distribution Coefficient, logD

-2.000

Water Solubility, LogSw

-2.46

Polar Surface Area

57.926

Acid Dissociation Constant (pKa)

14.06

Base Dissociation Constant (pKb)

10.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

E717-0724 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

DGK Inhibitors Library (10558 compounds)

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Kinases
Mechanism of action:
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with E717-0724 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E717-0724?
Check Price and Availability of E717-0724, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of E717-0724 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E717-0724
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E717-0724
  • 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 E717-0724 available by request