D030-0109 Screening compound: N-{2-[(2,4-dimethylphenyl)amino]cyclohexyl}benzenesulfonamide

D030-0109 Screening compound: N-{2-[(2,4-dimethylphenyl)amino]cyclohexyl}benzenesulfonamide
D030-0109 Screening compound: N-{2-[(2,4-dimethylphenyl)amino]cyclohexyl}benzenesulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D030-0109
N-{2-[(2,4-dimethylphenyl)amino]cyclohexyl}benzenesulfonamide

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

D030-0109

Molecular Formula

C20H26N2O2S (C20 H26 N2 O2 S)

Compound Name

N-{2-[(2,4-dimethylphenyl)amino]cyclohexyl}benzenesulfonamide

IUPAC name

N-{2-[(24-dimethylphenyl)amino]cyclohexyl}benzenesulfonamide

SMILES

Cc(cc1)cc(C)c1NC(CCCC1)C1NS(c1ccccc1)(=O)=O

InChI

InChI=1S/C20H26N2O2S/c1-15-12-13-18(16(2)14-15)21-19-10-6-7-11-20(19)22-25(23,24)17-8-4-3-5-9-17/h3-5,8-9,12-14,19-22H,6-7,10-11H2,1-2H3

InChI Key

BTBPPSWHHLFXPM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14811110

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

358.5

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.907

Distribution Coefficient, logD

4.906

Water Solubility, LogSw

-4.64

Polar Surface Area

51.785

Acid Dissociation Constant (pKa)

11.01

Base Dissociation Constant (pKb)

4.31

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

40.00

D030-0109 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

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

CNS targets activity set (6557 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with D030-0109 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D030-0109?
Check Price and Availability of D030-0109, 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 D030-0109 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D030-0109
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D030-0109
  • 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 D030-0109 available by request