Y040-4544 Screening compound: 3-hexyl-4,8-dimethyl-2-oxo-2H-chromen-7-yl acetate

Y040-4544 Screening compound: 3-hexyl-4,8-dimethyl-2-oxo-2H-chromen-7-yl acetate
Y040-4544 Screening compound: 3-hexyl-4,8-dimethyl-2-oxo-2H-chromen-7-yl acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound Y040-4544
3-hexyl-4,8-dimethyl-2-oxo-2H-chromen-7-yl 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

Y040-4544

Molecular Formula

C19H24O4 (C19 H24 O4)

Compound Name

3-hexyl-4,8-dimethyl-2-oxo-2H-chromen-7-yl acetate

IUPAC name

3-hexyl-48-dimethyl-2-oxo-2H-chromen-7-yl acetate

SMILES

CCCCCCC1=C(C)c(ccc(OC(C)=O)c2C)c2OC1=O

InChI

InChI=1S/C19H24O4/c1-5-6-7-8-9-16-12(2)15-10-11-17(22-14(4)20)13(3)18(15)23-19(16)21/h10-11H,5-9H2,1-4H3

InChI Key

NMUNDMYUQUORFB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02331304

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

316.4

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.247

Distribution Coefficient, logD

5.247

Water Solubility, LogSw

-5.05

Polar Surface Area

41.682

Acid Dissociation Constant (pKa)

22.67

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

47.40

References: we are preparing a list of scientific research reports with Y040-4544 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y040-4544?
Check Price and Availability of Y040-4544, 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 Y040-4544 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y040-4544
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y040-4544
  • 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 Y040-4544 available by request