Y041-2346 Screening compound: 4-[2-(5-methoxy-4,7-dimethyl-2-oxo-2H-chromen-3-yl)acetamido]butanoic acid

Y041-2346 Screening compound: 4-[2-(5-methoxy-4,7-dimethyl-2-oxo-2H-chromen-3-yl)acetamido]butanoic acid
Y041-2346 Screening compound: 4-[2-(5-methoxy-4,7-dimethyl-2-oxo-2H-chromen-3-yl)acetamido]butanoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound Y041-2346
4-[2-(5-methoxy-4,7-dimethyl-2-oxo-2H-chromen-3-yl)acetamido]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

Y041-2346

Molecular Formula

C18H21NO6 (C18 H21 NO6)

Compound Name

4-[2-(5-methoxy-4,7-dimethyl-2-oxo-2H-chromen-3-yl)acetamido]butanoic acid

IUPAC name

4-[2-(5-methoxy-47-dimethyl-2-oxo-2H-chromen-3-yl)acetamido]butanoic acid

SMILES

Cc1cc(OC(C(CC(NCCCC(O)=O)=O)=C2C)=O)c2c(OC)c1

InChI

InChI=1S/C18H21NO6/c1-10-7-13(24-3)17-11(2)12(18(23)25-14(17)8-10)9-15(20)19-6-4-5-16(21)22/h7-8H,4-6,9H2,1-3H3,(H,19,20)(H,21,22)

InChI Key

BVTSXPZENLCAJQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05675492

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

347.37

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.122

Distribution Coefficient, logD

-1.699

Water Solubility, LogSw

-1.63

Polar Surface Area

81.487

Acid Dissociation Constant (pKa)

4.58

Base Dissociation Constant (pKb)

1.24

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.90

Y041-2346 in Drug Discovery

Included in Screening Libraries

Arginase Targeted Library (2009 compounds)

STING Agonist Library (5895 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Male
  • Cardiovascular
  • Cancer
  • Immune system
Targets:
  • Others
  • Others

References: we are preparing a list of scientific research reports with Y041-2346 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y041-2346?
Check Price and Availability of Y041-2346, 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 Y041-2346 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y041-2346
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y041-2346
  • 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 Y041-2346 available by request