3948-0775 Screening compound: [3,4,5-tris(acetyloxy)-6-{[2-(2-methylphenoxy)ethyl]sulfanyl}oxan-2-yl]methyl acetate

3948-0775 Screening compound: [3,4,5-tris(acetyloxy)-6-{[2-(2-methylphenoxy)ethyl]sulfanyl}oxan-2-yl]methyl acetate
3948-0775 Screening compound: [3,4,5-tris(acetyloxy)-6-{[2-(2-methylphenoxy)ethyl]sulfanyl}oxan-2-yl]methyl acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound 3948-0775
[3,4,5-tris(acetyloxy)-6-{[2-(2-methylphenoxy)ethyl]sulfanyl}oxan-2-yl]methyl 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

3948-0775

Molecular Formula

C23H30O10S (C23 H30 O10 S)

Compound Name

[3,4,5-tris(acetyloxy)-6-{[2-(2-methylphenoxy)ethyl]sulfanyl}oxan-2-yl]methyl acetate

IUPAC name

[345-tris(acetyloxy)-6-{[2-(2-methylphenoxy)ethyl]sulfanyl}oxan-2-yl]methyl acetate

SMILES

CC(OCC(C(C(C1OC(C)=O)OC(C)=O)OC(C)=O)OC1SCCOc1c(C)cccc1)=O

InChI

InChI=1S/C23H30O10S/c1-13-8-6-7-9-18(13)28-10-11-34-23-22(32-17(5)27)21(31-16(4)26)20(30-15(3)25)19(33-23)12-29-14(2)24/h6-9,19-23H,10-12H2,1-5H3

InChI Key

LKOCTMAGJHLDOO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02753382

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

498.55

Hydrogen Bond Acceptors Count

15.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

14.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

2.580

Distribution Coefficient, logD

2.580

Water Solubility, LogSw

-2.54

Polar Surface Area

97.852

Acid Dissociation Constant (pKa)

24.24

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

5.00

Percent sp3 carbon bonding

56.50

References: we are preparing a list of scientific research reports with 3948-0775 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3948-0775?
Check Price and Availability of 3948-0775, 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 3948-0775 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3948-0775
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3948-0775
  • 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 3948-0775 available by request