0242-0575 Screening compound: 2-(4-methylbenzenesulfonamido)pentanedioic acid

0242-0575 Screening compound: 2-(4-methylbenzenesulfonamido)pentanedioic acid
0242-0575 Screening compound: 2-(4-methylbenzenesulfonamido)pentanedioic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 0242-0575
2-(4-methylbenzenesulfonamido)pentanedioic 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

0242-0575

Molecular Formula

C12H15NO6S (C12 H15 NO6 S)

Compound Name

2-(4-methylbenzenesulfonamido)pentanedioic acid

IUPAC name

2-(4-methylbenzenesulfonamido)pentanedioic acid

SMILES

Cc(cc1)ccc1S(NC(CCC(O)=O)C(O)=O)(=O)=O

InChI

InChI=1S/C12H15NO6S/c1-8-2-4-9(5-3-8)20(18,19)13-10(12(16)17)6-7-11(14)15/h2-5,10,13H,6-7H2,1H3,(H,14,15)(H,16,17)/t10-/m0/s1

InChI Key

KKOZKXBAPIYWAT-JTQLQIEISA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

301.32

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

0.144

Distribution Coefficient, logD

-3.908

Water Solubility, LogSw

-2.11

Polar Surface Area

98.904

Acid Dissociation Constant (pKa)

3.35

Base Dissociation Constant (pKb)

-6.42

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

33.30

References: we are preparing a list of scientific research reports with 0242-0575 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0242-0575?
Check Price and Availability of 0242-0575, 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 0242-0575 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0242-0575
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0242-0575
  • 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 0242-0575 available by request