Y041-2332 Screening compound: 2-[2-(7,8-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetamido]hexanoic acid

Y041-2332 Screening compound: 2-[2-(7,8-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetamido]hexanoic acid
Y041-2332 Screening compound: 2-[2-(7,8-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetamido]hexanoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound Y041-2332
2-[2-(7,8-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetamido]hexanoic 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

Y041-2332

Molecular Formula

C20H25NO7 (C20 H25 NO7)

Compound Name

2-[2-(7,8-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetamido]hexanoic acid

IUPAC name

2-[2-(78-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetamido]hexanoic acid

SMILES

CCCCC(C(O)=O)NC(CC(C(Oc1c2OC)=O)=C(C)c1ccc2OC)=O

InChI

InChI=1S/C20H25NO7/c1-5-6-7-14(19(23)24)21-16(22)10-13-11(2)12-8-9-15(26-3)18(27-4)17(12)28-20(13)25/h8-9,14H,5-7,10H2,1-4H3,(H,21,22)(H,23,24)/t14-/m0/s1

InChI Key

GDUQLCQDCXDBEW-AWEZNQCLSA-N

MDL Number (MFCD)

MFCD05673361

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

391.42

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.949

Distribution Coefficient, logD

-1.669

Water Solubility, LogSw

-2.70

Polar Surface Area

88.702

Acid Dissociation Constant (pKa)

3.78

Base Dissociation Constant (pKb)

-0.18

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

45.00

Y041-2332 in Drug Discovery

Included in Screening Libraries

Dark Chemical Matter Library (18430 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with Y041-2332 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y041-2332?
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What is the minimum amount of Y041-2332 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y041-2332
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y041-2332
  • 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 Y041-2332 available by request