D718-1190 Screening compound: 2-{1-[2-(4-ethylpiperazin-1-yl)acetyl]-3-oxopiperazin-2-yl}-N-(2-methylphenyl)acetamide

D718-1190 Screening compound: 2-{1-[2-(4-ethylpiperazin-1-yl)acetyl]-3-oxopiperazin-2-yl}-N-(2-methylphenyl)acetamide
D718-1190 Screening compound: 2-{1-[2-(4-ethylpiperazin-1-yl)acetyl]-3-oxopiperazin-2-yl}-N-(2-methylphenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D718-1190
2-{1-[2-(4-ethylpiperazin-1-yl)acetyl]-3-oxopiperazin-2-yl}-N-(2-methylphenyl)acetamide

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

D718-1190

Molecular Formula

C21H31N5O3 (C21 H31 N5 O3)

Compound Name

2-{1-[2-(4-ethylpiperazin-1-yl)acetyl]-3-oxopiperazin-2-yl}-N-(2-methylphenyl)acetamide

IUPAC name

2-{1-[2-(4-ethylpiperazin-1-yl)acetyl]-3-oxopiperazin-2-yl}-N-(2-methylphenyl)acetamide

SMILES

CCN1CCN(CC(N(CCN2)C(CC(Nc3c(C)cccc3)=O)C2=O)=O)CC1

InChI

InChI=1S/C21H31N5O3/c1-3-24-10-12-25(13-11-24)15-20(28)26-9-8-22-21(29)18(26)14-19(27)23-17-7-5-4-6-16(17)2/h4-7,18H,3,8-15H2,1-2H3,(H,22,29)(H,23,27)/t18-/m0/s1

InChI Key

BZXGJIYCJCYQKO-SFHVURJKSA-N

MDL Number (MFCD)

MFCD09463740

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

401.51

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

-0.489

Distribution Coefficient, logD

-1.283

Water Solubility, LogSw

-1.90

Polar Surface Area

70.630

Acid Dissociation Constant (pKa)

11.94

Base Dissociation Constant (pKb)

8.12

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

57.10

D718-1190 in Drug Discovery

Included in Screening Libraries

Nonpeptide Peptidomimetics PPI Library (18997 compounds)

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Protein-Protein Interaction Library (218420 compounds)

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Mimetics
  • Mimetics

References: we are preparing a list of scientific research reports with D718-1190 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D718-1190?
Check Price and Availability of D718-1190, 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 D718-1190 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D718-1190
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D718-1190
  • 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 D718-1190 available by request