E524-1044 Screening compound: 3-[6-oxopyrido[2,3-e]pyrrolo[1,2-a]pyrazin-5(6H)-yl]-N~1~-[3-(2-oxo-1-pyrrolidinyl)propyl]propanamide

E524-1044 Screening compound: 3-[6-oxopyrido[2,3-e]pyrrolo[1,2-a]pyrazin-5(6H)-yl]-N~1~-[3-(2-oxo-1-pyrrolidinyl)propyl]propanamide
E524-1044 Screening compound: 3-[6-oxopyrido[2,3-e]pyrrolo[1,2-a]pyrazin-5(6H)-yl]-N~1~-[3-(2-oxo-1-pyrrolidinyl)propyl]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E524-1044
3-[6-oxopyrido[2,3-e]pyrrolo[1,2-a]pyrazin-5(6H)-yl]-N~1~-[3-(2-oxo-1-pyrrolidinyl)propyl]propanamide

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

E524-1044

Molecular Formula

C20H23N5O3 (C20 H23 N5 O3)

Compound Name

3-[6-oxopyrido[2,3-e]pyrrolo[1,2-a]pyrazin-5(6H)-yl]-N~1~-[3-(2-oxo-1-pyrrolidinyl)propyl]propanamide

IUPAC name

3-{7-oxo-2810-triazatricyclo[7.4.0.0^{26}]trideca-1(13)35911-pentaen-8-yl}-N-[3-(2-oxopyrrolidin-1-yl)propyl]propanamide

SMILES

O=C(CCN(C1=O)c2ncccc2-n2c1ccc2)NCCCN(CCC1)C1=O

InChI

InChI=1S/C20H23N5O3/c26-17(21-10-4-12-23-11-3-7-18(23)27)8-14-25-19-15(5-1-9-22-19)24-13-2-6-16(24)20(25)28/h1-2,5-6,9,13H,3-4,7-8,10-12,14H2,(H,21,26)

InChI Key

SZPSGPLPLUPPSC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14894882

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

381.43

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

0.129

Distribution Coefficient, logD

0.129

Water Solubility, LogSw

-1.61

Polar Surface Area

69.100

Acid Dissociation Constant (pKa)

15.05

Base Dissociation Constant (pKb)

2.36

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

E524-1044 in Drug Discovery

Included in Screening Libraries

Indoleamine 2,3-dioxygenase 1 Focused Library (5816 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with E524-1044 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E524-1044?
Check Price and Availability of E524-1044, 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 E524-1044 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E524-1044
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E524-1044
  • 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 E524-1044 available by request