Y040-6669 Screening compound: 6-chloro-7-{[(2E)-3,7-dimethylocta-2,6-dien-1-yl]oxy}-4-propyl-2H-chromen-2-one

Y040-6669 Screening compound: 6-chloro-7-{[(2E)-3,7-dimethylocta-2,6-dien-1-yl]oxy}-4-propyl-2H-chromen-2-one
Y040-6669 Screening compound: 6-chloro-7-{[(2E)-3,7-dimethylocta-2,6-dien-1-yl]oxy}-4-propyl-2H-chromen-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound Y040-6669
6-chloro-7-{[(2E)-3,7-dimethylocta-2,6-dien-1-yl]oxy}-4-propyl-2H-chromen-2-one

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

Y040-6669

Molecular Formula

C22H27ClO3 (C22 H27 ClO3)

Compound Name

6-chloro-7-{[(2E)-3,7-dimethylocta-2,6-dien-1-yl]oxy}-4-propyl-2H-chromen-2-one

IUPAC name

6-chloro-7-{[(2E)-37-dimethylocta-26-dien-1-yl]oxy}-4-propyl-2H-chromen-2-one

SMILES

CCCC(c(c(O1)c2)cc(Cl)c2OC/C=C(\C)/CCC=C(C)C)=CC1=O

InChI

InChI=1S/C22H27ClO3/c1-5-7-17-12-22(24)26-20-14-21(19(23)13-18(17)20)25-11-10-16(4)9-6-8-15(2)3/h8,10,12-14H,5-7,9,11H2,1-4H3

InChI Key

KHCHBXFWFJVLJZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02925835

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

374.91

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

7.802

Distribution Coefficient, logD

7.802

Water Solubility, LogSw

-6.59

Polar Surface Area

28.150

Acid Dissociation Constant (pKa)

27.41

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.90

References: we are preparing a list of scientific research reports with Y040-6669 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y040-6669?
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What is the minimum amount of Y040-6669 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y040-6669
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y040-6669
  • 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 Y040-6669 available by request