C113-0059 Screening compound: N-cyclohexyl-2,1,3-benzoxadiazole-4-sulfonamide

C113-0059 Screening compound: N-cyclohexyl-2,1,3-benzoxadiazole-4-sulfonamide
C113-0059 Screening compound: N-cyclohexyl-2,1,3-benzoxadiazole-4-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C113-0059
N-cyclohexyl-2,1,3-benzoxadiazole-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

C113-0059

Molecular Formula

C12H15N3O3S (C12 H15 N3 O3 S)

Compound Name

N-cyclohexyl-2,1,3-benzoxadiazole-4-sulfonamide

IUPAC name

N-cyclohexyl-213-benzoxadiazole-4-sulfonamide

SMILES

O=S(c1cccc2nonc12)(NC1CCCCC1)=O

InChI

InChI=1S/C12H15N3O3S/c16-19(17,15-9-5-2-1-3-6-9)11-8-4-7-10-12(11)14-18-13-10/h4,7-9,15H,1-3,5-6H2

InChI Key

SFXDOYGYPUYVPN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01612717

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

281.34

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.937

Distribution Coefficient, logD

2.934

Water Solubility, LogSw

-3.31

Polar Surface Area

78.025

Acid Dissociation Constant (pKa)

9.60

Base Dissociation Constant (pKb)

-3.61

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

C113-0059 in Drug Discovery

Included in Screening Libraries

RAR (Nuclear receptors) Ligands Library (6524 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Respiratory tract
  • Eye
  • Male
  • Female
  • Hemic and lymphatic
  • Congenital
  • Skin
  • Endocrine
  • Immune system
Targets:
  • Nuclear receptors
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with C113-0059 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C113-0059?
Check Price and Availability of C113-0059, 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 C113-0059 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C113-0059
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C113-0059
  • 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 C113-0059 available by request