Y040-4686 Screening compound: 2-[2-(7-HYDROXY-4-METHYL-2-OXO-2H-CHROMEN-3-YL)ACETAMIDO]BENZAMIDE

Y040-4686 Screening compound: 2-[2-(7-HYDROXY-4-METHYL-2-OXO-2H-CHROMEN-3-YL)ACETAMIDO]BENZAMIDE
Y040-4686 Screening compound: 2-[2-(7-HYDROXY-4-METHYL-2-OXO-2H-CHROMEN-3-YL)ACETAMIDO]BENZAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound Y040-4686
2-[2-(7-HYDROXY-4-METHYL-2-OXO-2H-CHROMEN-3-YL)ACETAMIDO]BENZAMIDE

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

Y040-4686

Molecular Formula

C19H16N2O5 (C19 H16 N2 O5)

Compound Name

2-[2-(7-HYDROXY-4-METHYL-2-OXO-2H-CHROMEN-3-YL)ACETAMIDO]BENZAMIDE

IUPAC name

n/a

SMILES

CC(c(ccc(O)c1)c1O1)=C(CC(Nc(cccc2)c2C(N)=O)=O)C1=O

InChI

InChI=1S/C19H16N2O5/c1-10-12-7-6-11(22)8-16(12)26-19(25)14(10)9-17(23)21-15-5-3-2-4-13(15)18(20)24/h2-8,22H,9H2,1H3,(H2,20,24)(H,21,23)

InChI Key

XYOKATOJTHKUOG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06793267

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

352.35

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.362

Distribution Coefficient, logD

1.332

Water Solubility, LogSw

-2.40

Polar Surface Area

95.016

Acid Dissociation Constant (pKa)

8.56

Base Dissociation Constant (pKb)

-0.93

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.50

Y040-4686 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with Y040-4686 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y040-4686?
Check Price and Availability of Y040-4686, 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 Y040-4686 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y040-4686
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y040-4686
  • 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 Y040-4686 available by request