C301-7058 Screening compound: 3-hydroxy-1-propyl-1H,2H,5H-chromeno[3,4-b]pyrazine-2,5-dione

C301-7058 Screening compound: 3-hydroxy-1-propyl-1H,2H,5H-chromeno[3,4-b]pyrazine-2,5-dione
C301-7058 Screening compound: 3-hydroxy-1-propyl-1H,2H,5H-chromeno[3,4-b]pyrazine-2,5-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound C301-7058
3-hydroxy-1-propyl-1H,2H,5H-chromeno[3,4-b]pyrazine-2,5-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

C301-7058

Molecular Formula

C14H12N2O4 (C14 H12 N2 O4)

Compound Name

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

IUPAC name

3-hydroxy-1-propyl-1H2H5H-chromeno[34-b]pyrazine-25-dione

SMILES

CCCN(C(c(cccc1)c1OC1=O)=C1N=C1O)C1=O

InChI

InChI=1S/C14H12N2O4/c1-2-7-16-11-8-5-3-4-6-9(8)20-14(19)10(11)15-12(17)13(16)18/h3-6H,2,7H2,1H3,(H,15,17)

InChI Key

YFNZNWIGQACQPT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD13899597

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

272.26

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.365

Distribution Coefficient, logD

0.301

Water Solubility, LogSw

-2.24

Polar Surface Area

61.050

Acid Dissociation Constant (pKa)

6.38

Base Dissociation Constant (pKb)

3.43

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.40

C301-7058 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

BRD4 Targeted Library (4534 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cancer
  • Hemic and lymphatic
  • Cardiovascular
  • Metabolic
Agro:
  • Agro
Targets:
  • Others

References: we are preparing a list of scientific research reports with C301-7058 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C301-7058?
Check Price and Availability of C301-7058, 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 C301-7058 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C301-7058
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C301-7058
  • 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 C301-7058 available by request