5947-0073 Screening compound: 2-methyl-1H,2H,3H,4H,5H-chromeno[3,4-b]pyrazine-3,5-dione

5947-0073 Screening compound: 2-methyl-1H,2H,3H,4H,5H-chromeno[3,4-b]pyrazine-3,5-dione
5947-0073 Screening compound: 2-methyl-1H,2H,3H,4H,5H-chromeno[3,4-b]pyrazine-3,5-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 5947-0073
2-methyl-1H,2H,3H,4H,5H-chromeno[3,4-b]pyrazine-3,5-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

5947-0073

Molecular Formula

C12H10N2O3 (C12 H10 N2 O3)

Compound Name

2-methyl-1H,2H,3H,4H,5H-chromeno[3,4-b]pyrazine-3,5-dione

IUPAC name

2-methyl-1H2H3H4H5H-chromeno[34-b]pyrazine-35-dione

SMILES

CC1NC(c(cccc2)c2OC2=O)=C2NC1=O

InChI

InChI=1S/C12H10N2O3/c1-6-11(15)14-10-9(13-6)7-4-2-3-5-8(7)17-12(10)16/h2-6,13H,1H3,(H,14,15)/t6-/m1/s1

InChI Key

UQQURXMEVGIZJE-ZCFIWIBFSA-N

MDL Number (MFCD)

MFCD06250480

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

230.22

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

0.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

0.728

Distribution Coefficient, logD

0.727

Water Solubility, LogSw

-2.11

Polar Surface Area

57.558

Acid Dissociation Constant (pKa)

10.25

Base Dissociation Constant (pKb)

-3.63

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

16.70

5947-0073 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 5947-0073 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5947-0073?
Check Price and Availability of 5947-0073, 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 5947-0073 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5947-0073
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5947-0073
  • 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 5947-0073 available by request