8012-6635 Screening compound: 2-benzenesulfonamido-4-methanesulfonylbutanoic acid

8012-6635 Screening compound: 2-benzenesulfonamido-4-methanesulfonylbutanoic acid
8012-6635 Screening compound: 2-benzenesulfonamido-4-methanesulfonylbutanoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 8012-6635
2-benzenesulfonamido-4-methanesulfonylbutanoic acid

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

8012-6635

Molecular Formula

C11H15NO6S2 (C11 H15 NO6 S2)

Compound Name

2-benzenesulfonamido-4-methanesulfonylbutanoic acid

IUPAC name

2-benzenesulfonamido-4-methanesulfonylbutanoic acid

SMILES

CS(CCC(C(O)=O)NS(c1ccccc1)(=O)=O)(=O)=O

InChI

InChI=1S/C11H15NO6S2/c1-19(15,16)8-7-10(11(13)14)12-20(17,18)9-5-3-2-4-6-9/h2-6,10,12H,7-8H2,1H3,(H,13,14)/t10-/m0/s1

InChI Key

FAHUCQPCECQZOD-JTQLQIEISA-N

MDL Number (MFCD)

MFCD03034476

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

321.38

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

-0.772

Distribution Coefficient, logD

-4.535

Water Solubility, LogSw

-1.82

Polar Surface Area

99.533

Acid Dissociation Constant (pKa)

3.64

Base Dissociation Constant (pKb)

-8.53

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

36.40

References: we are preparing a list of scientific research reports with 8012-6635 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8012-6635?
Check Price and Availability of 8012-6635, 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 8012-6635 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8012-6635
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8012-6635
  • 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 8012-6635 available by request