8013-5685 Screening compound: N-{[1,1'-biphenyl]-4-yl}-2,5-dimethylthiophene-3-sulfonamide

8013-5685 Screening compound: N-{[1,1'-biphenyl]-4-yl}-2,5-dimethylthiophene-3-sulfonamide
8013-5685 Screening compound: N-{[1,1'-biphenyl]-4-yl}-2,5-dimethylthiophene-3-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8013-5685
N-{[1,1'-biphenyl]-4-yl}-2,5-dimethylthiophene-3-sulfonamide

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

8013-5685

Molecular Formula

C18H17NO2S2 (C18 H17 NO2 S2)

Compound Name

N-{[1,1'-biphenyl]-4-yl}-2,5-dimethylthiophene-3-sulfonamide

IUPAC name

N-{[11'-biphenyl]-4-yl}-25-dimethylthiophene-3-sulfonamide

SMILES

Cc1cc(S(Nc(cc2)ccc2-c2ccccc2)(=O)=O)c(C)s1

InChI

InChI=1S/C18H17NO2S2/c1-13-12-18(14(2)22-13)23(20,21)19-17-10-8-16(9-11-17)15-6-4-3-5-7-15/h3-12,19H,1-2H3

InChI Key

LBUNJHSGBOXMBB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03766770

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

343.47

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.211

Distribution Coefficient, logD

5.207

Water Solubility, LogSw

-5.31

Polar Surface Area

41.635

Acid Dissociation Constant (pKa)

9.52

Base Dissociation Constant (pKb)

-9.77

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

8013-5685 in Drug Discovery

Included in Screening Libraries

Regenerative Medicine Focused Library (23016 compounds)

Receptor-type Protein Tyrosine Phosphatases Library (3746 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds
  • Cancer
  • Digestive system
  • Nervous system
  • Female
  • Metabolic
  • Endocrine
Targets:
  • Phosphatases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 8013-5685 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8013-5685?
Check Price and Availability of 8013-5685, 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 8013-5685 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8013-5685
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8013-5685
  • 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 8013-5685 available by request