C206-0098 Screening compound: N-cyclooctyl-4-(2-methylpropyl)benzene-1-sulfonamide

C206-0098 Screening compound: N-cyclooctyl-4-(2-methylpropyl)benzene-1-sulfonamide
C206-0098 Screening compound: N-cyclooctyl-4-(2-methylpropyl)benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C206-0098
N-cyclooctyl-4-(2-methylpropyl)benzene-1-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

C206-0098

Molecular Formula

C18H29NO2S (C18 H29 NO2 S)

Compound Name

N-cyclooctyl-4-(2-methylpropyl)benzene-1-sulfonamide

IUPAC name

N-cyclooctyl-4-(2-methylpropyl)benzene-1-sulfonamide

SMILES

CC(C)Cc(cc1)ccc1S(NC1CCCCCCC1)(=O)=O

InChI

InChI=1S/C18H29NO2S/c1-15(2)14-16-10-12-18(13-11-16)22(20,21)19-17-8-6-4-3-5-7-9-17/h10-13,15,17,19H,3-9,14H2,1-2H3

InChI Key

OPJPQAYXHATUIM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05086791

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

323.5

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.957

Distribution Coefficient, logD

5.957

Water Solubility, LogSw

-5.48

Polar Surface Area

42.266

Acid Dissociation Constant (pKa)

11.57

Base Dissociation Constant (pKb)

-4.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

66.70

C206-0098 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C206-0098 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C206-0098?
Check Price and Availability of C206-0098, 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 C206-0098 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C206-0098
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C206-0098
  • 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 C206-0098 available by request