E717-0219 Screening compound: 3-[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]-5-propyl-3H,4H,5H-pyridazino[4,5-b]indol-4-one

E717-0219 Screening compound: 3-[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]-5-propyl-3H,4H,5H-pyridazino[4,5-b]indol-4-one
E717-0219 Screening compound: 3-[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]-5-propyl-3H,4H,5H-pyridazino[4,5-b]indol-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound E717-0219
3-[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]-5-propyl-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

E717-0219

Molecular Formula

C23H22N4O2 (C23 H22 N4 O2)

Compound Name

3-[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]-5-propyl-3H,4H,5H-pyridazino[4,5-b]indol-4-one

IUPAC name

3-[2-(23-dihydro-1H-indol-1-yl)-2-oxoethyl]-5-propyl-3H4H5H-pyridazino[45-b]indol-4-one

SMILES

CCCn1c(C(N(CC(N(CC2)c3c2cccc3)=O)N=C2)=O)c2c2c1cccc2

InChI

InChI=1S/C23H22N4O2/c1-2-12-26-20-10-6-4-8-17(20)18-14-24-27(23(29)22(18)26)15-21(28)25-13-11-16-7-3-5-9-19(16)25/h3-10,14H,2,11-13,15H2,1H3

InChI Key

VJORKDAJAZMHHE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14912105

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

386.45

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.304

Distribution Coefficient, logD

3.304

Water Solubility, LogSw

-3.42

Polar Surface Area

44.744

Acid Dissociation Constant (pKa)

17.29

Base Dissociation Constant (pKb)

0.40

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.10

E717-0219 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with E717-0219 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E717-0219?
Check Price and Availability of E717-0219, 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 E717-0219 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E717-0219
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E717-0219
  • 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 E717-0219 available by request