1134-0107 Screening compound: 3-(benzenesulfonyl)propanoic acid

1134-0107 Screening compound: 3-(benzenesulfonyl)propanoic acid
1134-0107 Screening compound: 3-(benzenesulfonyl)propanoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 1134-0107
3-(benzenesulfonyl)propanoic 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

1134-0107

Molecular Formula

C9H10O4S (C9 H10 O4 S)

Compound Name

3-(benzenesulfonyl)propanoic acid

IUPAC name

3-(benzenesulfonyl)propanoic acid

SMILES

OC(CCS(c1ccccc1)(=O)=O)=O

InChI

InChI=1S/C9H10O4S/c10-9(11)6-7-14(12,13)8-4-2-1-3-5-8/h1-5H,6-7H2,(H,10,11)

InChI Key

WGTYYNCSWCKXAI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00010141

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

214.24

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

0.306

Distribution Coefficient, logD

-3.286

Water Solubility, LogSw

-1.71

Polar Surface Area

57.659

Acid Dissociation Constant (pKa)

3.81

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

1134-0107 in Drug Discovery

Included in Screening Libraries

STING Agonist Library (5895 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Receptor-type Protein Tyrosine Phosphatases Library (3746 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Immune system
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
  • Cancer
  • Digestive system
  • Nervous system
  • Female
  • Metabolic
  • Endocrine
Targets:
  • Others
  • Phosphatases
Mechanism of action:
  • Epigenetic
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 1134-0107 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1134-0107?
Check Price and Availability of 1134-0107, 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 1134-0107 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1134-0107
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1134-0107
  • 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 1134-0107 available by request