Y040-1840 Screening compound: benzyl 2-[(3,4,7-trimethyl-2-oxo-2H-chromen-5-yl)oxy]acetate

Y040-1840 Screening compound: benzyl 2-[(3,4,7-trimethyl-2-oxo-2H-chromen-5-yl)oxy]acetate
Y040-1840 Screening compound: benzyl 2-[(3,4,7-trimethyl-2-oxo-2H-chromen-5-yl)oxy]acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound Y040-1840
benzyl 2-[(3,4,7-trimethyl-2-oxo-2H-chromen-5-yl)oxy]acetate

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

Y040-1840

Molecular Formula

C21H20O5 (C21 H20 O5)

Compound Name

benzyl 2-[(3,4,7-trimethyl-2-oxo-2H-chromen-5-yl)oxy]acetate

IUPAC name

benzyl 2-[(347-trimethyl-2-oxo-2H-chromen-5-yl)oxy]acetate

SMILES

Cc1cc(OC(C(C)=C2C)=O)c2c(OCC(OCc2ccccc2)=O)c1

InChI

InChI=1S/C21H20O5/c1-13-9-17(20-14(2)15(3)21(23)26-18(20)10-13)24-12-19(22)25-11-16-7-5-4-6-8-16/h4-10H,11-12H2,1-3H3

InChI Key

SSGQLULNMMMGQY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03713240

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

352.39

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.326

Distribution Coefficient, logD

4.326

Water Solubility, LogSw

-4.79

Polar Surface Area

49.009

Acid Dissociation Constant (pKa)

24.27

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.80

Y040-1840 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 Y040-1840 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y040-1840?
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What is the minimum amount of Y040-1840 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y040-1840
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y040-1840
  • 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 Y040-1840 available by request