Y041-5334 Screening compound: 2-oxo-4-propyl-2H-chromen-7-yl 1-benzenesulfonate

Y041-5334 Screening compound: 2-oxo-4-propyl-2H-chromen-7-yl 1-benzenesulfonate
Y041-5334 Screening compound: 2-oxo-4-propyl-2H-chromen-7-yl 1-benzenesulfonate alternative view

Chemical Structure Depiction of ChemDiv screening compound Y041-5334
2-oxo-4-propyl-2H-chromen-7-yl 1-benzenesulfonate

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

Y041-5334

Molecular Formula

C18H16O5S (C18 H16 O5 S)

Compound Name

2-oxo-4-propyl-2H-chromen-7-yl 1-benzenesulfonate

IUPAC name

2-oxo-4-propyl-2H-chromen-7-yl benzenesulfonate

SMILES

CCCC(c(ccc(OS(c1ccccc1)(=O)=O)c1)c1O1)=CC1=O

InChI

InChI=1S/C18H16O5S/c1-2-6-13-11-18(19)22-17-12-14(9-10-16(13)17)23-24(20,21)15-7-4-3-5-8-15/h3-5,7-12H,2,6H2,1H3

InChI Key

BRMCTVWRJHRBPH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03706945

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

344.39

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.681

Distribution Coefficient, logD

3.681

Water Solubility, LogSw

-4.00

Polar Surface Area

56.407

Acid Dissociation Constant (pKa)

27.41

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.67

References: we are preparing a list of scientific research reports with Y041-5334 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y041-5334?
Check Price and Availability of Y041-5334, 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 Y041-5334 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y041-5334
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y041-5334
  • 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 Y041-5334 available by request