8007-1967 Screening compound: N-[(oxolan-2-yl)methyl]-2,1,3-benzothiadiazole-4-sulfonamide

8007-1967 Screening compound: N-[(oxolan-2-yl)methyl]-2,1,3-benzothiadiazole-4-sulfonamide
8007-1967 Screening compound: N-[(oxolan-2-yl)methyl]-2,1,3-benzothiadiazole-4-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8007-1967
N-[(oxolan-2-yl)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

8007-1967

Molecular Formula

C11H13N3O3S2 (C11 H13 N3 O3 S2)

Compound Name

N-[(oxolan-2-yl)methyl]-2,1,3-benzothiadiazole-4-sulfonamide

IUPAC name

N-[(oxolan-2-yl)methyl]-213-benzothiadiazole-4-sulfonamide

SMILES

O=S(c1cccc2nsnc12)(NCC1OCCC1)=O

InChI

InChI=1S/C11H13N3O3S2/c15-19(16,12-7-8-3-2-6-17-8)10-5-1-4-9-11(10)14-18-13-9/h1,4-5,8,12H,2-3,6-7H2/t8-/m1/s1

InChI Key

QNCQJOMNJVFJEL-MRVPVSSYSA-N

MDL Number (MFCD)

MFCD00681416

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

299.37

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.326

Distribution Coefficient, logD

1.324

Water Solubility, LogSw

-2.17

Polar Surface Area

71.604

Acid Dissociation Constant (pKa)

9.81

Base Dissociation Constant (pKb)

-1.17

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

45.50

8007-1967 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Dark Chemical Matter Library (18430 compounds)

Selective Target Activity Profiling Library (14702 compounds)

Akt-Targeted Library (14764 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool
Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 8007-1967 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8007-1967?
Check Price and Availability of 8007-1967, 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 8007-1967 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8007-1967
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8007-1967
  • 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 8007-1967 available by request