E524-1684 Screening compound: N~1~-[4-(acetylamino)phenyl]-4-{[6-oxopyrido[2,3-e]pyrrolo[1,2-a]pyrazin-5(6H)-yl]methyl}benzamide

E524-1684 Screening compound: N~1~-[4-(acetylamino)phenyl]-4-{[6-oxopyrido[2,3-e]pyrrolo[1,2-a]pyrazin-5(6H)-yl]methyl}benzamide
E524-1684 Screening compound: N~1~-[4-(acetylamino)phenyl]-4-{[6-oxopyrido[2,3-e]pyrrolo[1,2-a]pyrazin-5(6H)-yl]methyl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E524-1684
N~1~-[4-(acetylamino)phenyl]-4-{[6-oxopyrido[2,3-e]pyrrolo[1,2-a]pyrazin-5(6H)-yl]methyl}benzamide

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

E524-1684

Molecular Formula

C26H21N5O3 (C26 H21 N5 O3)

Compound Name

N~1~-[4-(acetylamino)phenyl]-4-{[6-oxopyrido[2,3-e]pyrrolo[1,2-a]pyrazin-5(6H)-yl]methyl}benzamide

IUPAC name

N-(4-acetamidophenyl)-4-({7-oxo-2810-triazatricyclo[7.4.0.0^{26}]trideca-1(13)35911-pentaen-8-yl}methyl)benzamide

SMILES

CC(Nc(cc1)ccc1NC(c1ccc(CN(C2=O)c3ncccc3-n3c2ccc3)cc1)=O)=O

InChI

InChI=1S/C26H21N5O3/c1-17(32)28-20-10-12-21(13-11-20)29-25(33)19-8-6-18(7-9-19)16-31-24-22(4-2-14-27-24)30-15-3-5-23(30)26(31)34/h2-15H,16H2,1H3,(H,28,32)(H,29,33)

InChI Key

YHUOYQIXSZUFAO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27599769

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

451.48

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.353

Distribution Coefficient, logD

3.353

Water Solubility, LogSw

-3.49

Polar Surface Area

73.650

Acid Dissociation Constant (pKa)

11.00

Base Dissociation Constant (pKb)

2.18

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

7.70

E524-1684 in Drug Discovery

Included in Screening Libraries

Chelators targeting matrix metalloproteinases library (8930 compounds)

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Cardiovascular
Targets:
  • Proteases
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Mimetics

References: we are preparing a list of scientific research reports with E524-1684 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E524-1684?
Check Price and Availability of E524-1684, 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 E524-1684 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E524-1684
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E524-1684
  • 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 E524-1684 available by request