C085-2104 Screening compound: methyl 2-(2,5-dimethoxybenzenesulfonamido)benzoate

C085-2104 Screening compound: methyl 2-(2,5-dimethoxybenzenesulfonamido)benzoate
C085-2104 Screening compound: methyl 2-(2,5-dimethoxybenzenesulfonamido)benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound C085-2104
methyl 2-(2,5-dimethoxybenzenesulfonamido)benzoate

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

C085-2104

Molecular Formula

C16H17NO6S (C16 H17 NO6 S)

Compound Name

methyl 2-(2,5-dimethoxybenzenesulfonamido)benzoate

IUPAC name

methyl 2-(25-dimethoxybenzenesulfonamido)benzoate

SMILES

COC(c(cccc1)c1NS(c(cc(cc1)OC)c1OC)(=O)=O)=O

InChI

InChI=1S/C16H17NO6S/c1-21-11-8-9-14(22-2)15(10-11)24(19,20)17-13-7-5-4-6-12(13)16(18)23-3/h4-10,17H,1-3H3

InChI Key

QZBQNPNTEXDLRV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03828628

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

351.38

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.627

Distribution Coefficient, logD

0.628

Water Solubility, LogSw

-3.24

Polar Surface Area

76.538

Acid Dissociation Constant (pKa)

5.41

Base Dissociation Constant (pKb)

-11.06

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.80

C085-2104 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

Antiparasite Library (23996 compounds)

Protein-Protein Interaction Library (218420 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Chemokine Receptor-Targeted Library (18382 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Infections
  • Immune system
  • animal
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
  • Immune system
Agro:
  • Agro
Mechanism of action:
  • PPI modulators
  • Receptor's ligands
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with C085-2104 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C085-2104?
Check Price and Availability of C085-2104, 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 C085-2104 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C085-2104
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C085-2104
  • 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 C085-2104 available by request