4312-0013 Screening compound: 8-methoxy-N-(4-methylphenyl)-2-oxo-2H-chromene-3-carboxamide

4312-0013 Screening compound: 8-methoxy-N-(4-methylphenyl)-2-oxo-2H-chromene-3-carboxamide
4312-0013 Screening compound: 8-methoxy-N-(4-methylphenyl)-2-oxo-2H-chromene-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 4312-0013
8-methoxy-N-(4-methylphenyl)-2-oxo-2H-chromene-3-carboxamide

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

4312-0013

Molecular Formula

C18H15NO4 (C18 H15 NO4)

Compound Name

8-methoxy-N-(4-methylphenyl)-2-oxo-2H-chromene-3-carboxamide

IUPAC name

8-methoxy-N-(4-methylphenyl)-2-oxo-2H-chromene-3-carboxamide

SMILES

Cc(cc1)ccc1NC(C1=Cc2cccc(OC)c2OC1=O)=O

InChI

InChI=1S/C18H15NO4/c1-11-6-8-13(9-7-11)19-17(20)14-10-12-4-3-5-15(22-2)16(12)23-18(14)21/h3-10H,1-2H3,(H,19,20)

InChI Key

IEVIUFYDGZWVDK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00807982

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

309.32

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.250

Distribution Coefficient, logD

3.248

Water Solubility, LogSw

-3.70

Polar Surface Area

51.566

Acid Dissociation Constant (pKa)

9.78

Base Dissociation Constant (pKb)

-0.75

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

4312-0013 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with 4312-0013 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4312-0013?
Check Price and Availability of 4312-0013, 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 4312-0013 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4312-0013
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4312-0013
  • 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 4312-0013 available by request