3260-0314 Screening compound: 5-methoxy-1H-1,3-benzodiazole-2-sulfonic acid

3260-0314 Screening compound: 5-methoxy-1H-1,3-benzodiazole-2-sulfonic acid
3260-0314 Screening compound: 5-methoxy-1H-1,3-benzodiazole-2-sulfonic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 3260-0314
5-methoxy-1H-1,3-benzodiazole-2-sulfonic 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

3260-0314

Molecular Formula

C8H8N2O4S (C8 H8 N2 O4 S)

Compound Name

5-methoxy-1H-1,3-benzodiazole-2-sulfonic acid

IUPAC name

5-methoxy-1H-13-benzodiazole-2-sulfonic acid

SMILES

COc(cc1)cc2c1[nH]c(S(O)(=O)=O)n2

InChI

InChI=1S/C8H8N2O4S/c1-14-5-2-3-6-7(4-5)10-8(9-6)15(11,12)13/h2-4H,1H3,(H,9,10)(H,11,12,13)

InChI Key

SZHBMDJFGQCIPU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00965563

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

228.23

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

-1.261

Distribution Coefficient, logD

-15.052

Water Solubility, LogSw

-2.17

Polar Surface Area

69.037

Acid Dissociation Constant (pKa)

-3.34

Base Dissociation Constant (pKb)

-1.48

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

3260-0314 in Drug Discovery

Included in Screening Libraries

STING Agonist Library (5895 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with 3260-0314 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3260-0314?
Check Price and Availability of 3260-0314, 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 3260-0314 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3260-0314
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3260-0314
  • 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 3260-0314 available by request