6008-0221 Screening compound: 1-(2,4,5-trimethylbenzenesulfonyl)piperidine-4-carboxamide

6008-0221 Screening compound: 1-(2,4,5-trimethylbenzenesulfonyl)piperidine-4-carboxamide
6008-0221 Screening compound: 1-(2,4,5-trimethylbenzenesulfonyl)piperidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 6008-0221
1-(2,4,5-trimethylbenzenesulfonyl)piperidine-4-carboxamide

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

6008-0221

Molecular Formula

C15H22N2O3S (C15 H22 N2 O3 S)

Compound Name

1-(2,4,5-trimethylbenzenesulfonyl)piperidine-4-carboxamide

IUPAC name

1-(245-trimethylbenzenesulfonyl)piperidine-4-carboxamide

SMILES

Cc(c(C)c1)cc(C)c1S(N(CC1)CCC1C(N)=O)(=O)=O

InChI

InChI=1S/C15H22N2O3S/c1-10-8-12(3)14(9-11(10)2)21(19,20)17-6-4-13(5-7-17)15(16)18/h8-9,13H,4-7H2,1-3H3,(H2,16,18)

InChI Key

SCKUNMOASFQGEH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03785675

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

310.42

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.143

Distribution Coefficient, logD

2.143

Water Solubility, LogSw

-2.30

Polar Surface Area

66.008

Acid Dissociation Constant (pKa)

14.92

Base Dissociation Constant (pKb)

4.69

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

53.30

6008-0221 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

NOTUM (Wnt signaling) Library (3881 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with 6008-0221 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6008-0221?
Check Price and Availability of 6008-0221, 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 6008-0221 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6008-0221
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6008-0221
  • 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 6008-0221 available by request