0227-0246 Screening compound: N-(2-cyanoethyl)-N-methyl-2,1,3-benzothiadiazole-4-sulfonamide

0227-0246 Screening compound: N-(2-cyanoethyl)-N-methyl-2,1,3-benzothiadiazole-4-sulfonamide
0227-0246 Screening compound: N-(2-cyanoethyl)-N-methyl-2,1,3-benzothiadiazole-4-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 0227-0246
N-(2-cyanoethyl)-N-methyl-2,1,3-benzothiadiazole-4-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

0227-0246

Molecular Formula

C10H10N4O2S2 (C10 H10 N4 O2 S2)

Compound Name

N-(2-cyanoethyl)-N-methyl-2,1,3-benzothiadiazole-4-sulfonamide

IUPAC name

N-(2-cyanoethyl)-N-methyl-213-benzothiadiazole-4-sulfonamide

SMILES

CN(CCC#N)S(c1cccc2nsnc12)(=O)=O

InChI

InChI=1S/C10H10N4O2S2/c1-14(7-3-6-11)18(15,16)9-5-2-4-8-10(9)13-17-12-8/h2,4-5H,3,7H2,1H3

InChI Key

BCSAJDHRZNELPG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00220359

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

282.35

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.148

Distribution Coefficient, logD

1.148

Water Solubility, LogSw

-2.07

Polar Surface Area

71.497

Acid Dissociation Constant (pKa)

21.70

Base Dissociation Constant (pKb)

-1.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

References: we are preparing a list of scientific research reports with 0227-0246 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0227-0246?
Check Price and Availability of 0227-0246, 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 0227-0246 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0227-0246
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0227-0246
  • 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 0227-0246 available by request