5826-0428 Screening compound: 5-(4-OXO-4H-3,1-BENZOXAZIN-2-YL)-2-PROPYL-2,3-DIHYDRO-1H-ISOINDOLE-1,3-DIONE

5826-0428 Screening compound: 5-(4-OXO-4H-3,1-BENZOXAZIN-2-YL)-2-PROPYL-2,3-DIHYDRO-1H-ISOINDOLE-1,3-DIONE
5826-0428 Screening compound: 5-(4-OXO-4H-3,1-BENZOXAZIN-2-YL)-2-PROPYL-2,3-DIHYDRO-1H-ISOINDOLE-1,3-DIONE alternative view

Chemical Structure Depiction of ChemDiv screening compound 5826-0428
5-(4-OXO-4H-3,1-BENZOXAZIN-2-YL)-2-PROPYL-2,3-DIHYDRO-1H-ISOINDOLE-1,3-DIONE

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

5826-0428

Molecular Formula

C19H14N2O4 (C19 H14 N2 O4)

Compound Name

5-(4-OXO-4H-3,1-BENZOXAZIN-2-YL)-2-PROPYL-2,3-DIHYDRO-1H-ISOINDOLE-1,3-DIONE

IUPAC name

n/a

SMILES

CCCN(C(c(cc1)c2cc1C(O1)=Nc(cccc3)c3C1=O)=O)C2=O

InChI

InChI=1S/C19H14N2O4/c1-2-9-21-17(22)12-8-7-11(10-14(12)18(21)23)16-20-15-6-4-3-5-13(15)19(24)25-16/h3-8,10H,2,9H2,1H3

InChI Key

QNMFIMPTXXOFBI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03082049

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

334.33

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.795

Distribution Coefficient, logD

2.795

Water Solubility, LogSw

-3.56

Polar Surface Area

59.688

Acid Dissociation Constant (pKa)

27.65

Base Dissociation Constant (pKb)

-0.86

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.00

5826-0428 in Drug Discovery

Included in Screening Libraries

STING Agonist Library (5895 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with 5826-0428 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5826-0428?
Check Price and Availability of 5826-0428, 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 5826-0428 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5826-0428
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5826-0428
  • 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 5826-0428 available by request