8017-9498 Screening compound: 2-(octylsulfonyl)ethyl 1-octanesulfonate

8017-9498 Screening compound: 2-(octylsulfonyl)ethyl 1-octanesulfonate
8017-9498 Screening compound: 2-(octylsulfonyl)ethyl 1-octanesulfonate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8017-9498
2-(octylsulfonyl)ethyl 1-octanesulfonate

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

8017-9498

Molecular Formula

C18H38O5S2 (C18 H38 O5 S2)

Compound Name

2-(octylsulfonyl)ethyl 1-octanesulfonate

IUPAC name

2-(octane-1-sulfonyl)ethyl octane-1-sulfonate

SMILES

CCCCCCCCS(CCOS(CCCCCCCC)(=O)=O)(=O)=O

InChI

InChI=1S/C18H38O5S2/c1-3-5-7-9-11-13-16-24(19,20)18-15-23-25(21,22)17-14-12-10-8-6-4-2/h3-18H2,1-2H3

InChI Key

MJWPFIJSQHYUSM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06619423

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

398.63

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

18.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.454

Distribution Coefficient, logD

5.454

Water Solubility, LogSw

-5.33

Polar Surface Area

65.164

Acid Dissociation Constant (pKa)

20.88

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

100.00

8017-9498 in Drug Discovery

Included in Screening Libraries

Regenerative Medicine Focused Library (23016 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds

References: we are preparing a list of scientific research reports with 8017-9498 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8017-9498?
Check Price and Availability of 8017-9498, 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 8017-9498 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8017-9498
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8017-9498
  • 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 8017-9498 available by request