8019-4336 Screening compound: 1-propyl-1H-1,3-benzodiazole-2-sulfonic acid

8019-4336 Screening compound: 1-propyl-1H-1,3-benzodiazole-2-sulfonic acid
8019-4336 Screening compound: 1-propyl-1H-1,3-benzodiazole-2-sulfonic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 8019-4336
1-propyl-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

8019-4336

Molecular Formula

C10H12N2O3S (C10 H12 N2 O3 S)

Compound Name

1-propyl-1H-1,3-benzodiazole-2-sulfonic acid

IUPAC name

1-propyl-1H-13-benzodiazole-2-sulfonic acid

SMILES

CCCn1c(S(O)(=O)=O)nc2c1cccc2

InChI

InChI=1S/C10H12N2O3S/c1-2-7-12-9-6-4-3-5-8(9)11-10(12)16(13,14)15/h3-6H,2,7H2,1H3,(H,13,14,15)

InChI Key

FWKRDYUGOORJQT-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

240.28

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

0.261

Distribution Coefficient, logD

-13.530

Water Solubility, LogSw

-1.84

Polar Surface Area

53.784

Acid Dissociation Constant (pKa)

-3.34

Base Dissociation Constant (pKb)

-1.87

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

References: we are preparing a list of scientific research reports with 8019-4336 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8019-4336?
Check Price and Availability of 8019-4336, 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 8019-4336 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8019-4336
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8019-4336
  • 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 8019-4336 available by request