Y040-8279 Screening compound: 2-{2-[(7-methyl-2-oxo-4-propyl-2H-chromen-5-yl)oxy]acetamido}-4-(methylsulfanyl)butanoic acid

Y040-8279 Screening compound: 2-{2-[(7-methyl-2-oxo-4-propyl-2H-chromen-5-yl)oxy]acetamido}-4-(methylsulfanyl)butanoic acid
Y040-8279 Screening compound: 2-{2-[(7-methyl-2-oxo-4-propyl-2H-chromen-5-yl)oxy]acetamido}-4-(methylsulfanyl)butanoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound Y040-8279
2-{2-[(7-methyl-2-oxo-4-propyl-2H-chromen-5-yl)oxy]acetamido}-4-(methylsulfanyl)butanoic acid

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

Y040-8279

Molecular Formula

C20H25NO6S (C20 H25 NO6 S)

Compound Name

2-{2-[(7-methyl-2-oxo-4-propyl-2H-chromen-5-yl)oxy]acetamido}-4-(methylsulfanyl)butanoic acid

IUPAC name

(2S)-2-{2-[(7-methyl-2-oxo-4-propyl-2H-chromen-5-yl)oxy]acetamido}-4-(methylsulfanyl)butanoic acid

SMILES

CCCC(c(c(O1)cc(C)c2)c2OCC(NC(CCSC)C(O)=O)=O)=CC1=O

InChI

InChI=1S/C20H25NO6S/c1-4-5-13-10-18(23)27-16-9-12(2)8-15(19(13)16)26-11-17(22)21-14(20(24)25)6-7-28-3/h8-10,14H,4-7,11H2,1-3H3,(H,21,22)(H,24,25)/t14-/m0/s1

InChI Key

GJLYRVSNVHFNGA-AWEZNQCLSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

407.49

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.282

Distribution Coefficient, logD

-1.336

Water Solubility, LogSw

-2.52

Polar Surface Area

80.741

Acid Dissociation Constant (pKa)

3.78

Base Dissociation Constant (pKb)

-1.49

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

45.00

Y040-8279 in Drug Discovery

Included in Screening Libraries

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 Y040-8279 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y040-8279?
Check Price and Availability of Y040-8279, 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 Y040-8279 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y040-8279
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y040-8279
  • 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 Y040-8279 available by request