4952-0026 Screening compound: 6-(4-methylbenzenesulfonamido)-N-(1,3-thiazol-2-yl)hexanamide

4952-0026 Screening compound: 6-(4-methylbenzenesulfonamido)-N-(1,3-thiazol-2-yl)hexanamide
4952-0026 Screening compound: 6-(4-methylbenzenesulfonamido)-N-(1,3-thiazol-2-yl)hexanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 4952-0026
6-(4-methylbenzenesulfonamido)-N-(1,3-thiazol-2-yl)hexanamide

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

4952-0026

Molecular Formula

C16H21N3O3S2 (C16 H21 N3 O3 S2)

Compound Name

6-(4-methylbenzenesulfonamido)-N-(1,3-thiazol-2-yl)hexanamide

IUPAC name

6-(4-methylbenzenesulfonamido)-N-(13-thiazol-2-yl)hexanamide

SMILES

Cc(cc1)ccc1S(NCCCCCC(Nc1nccs1)=O)(=O)=O

InChI

InChI=1S/C16H21N3O3S2/c1-13-6-8-14(9-7-13)24(21,22)18-10-4-2-3-5-15(20)19-16-17-11-12-23-16/h6-9,11-12,18H,2-5,10H2,1H3,(H,17,19,20)

InChI Key

YRMXMJDXXJCTQG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03042345

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

367.49

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.763

Distribution Coefficient, logD

2.762

Water Solubility, LogSw

-3.30

Polar Surface Area

75.466

Acid Dissociation Constant (pKa)

10.05

Base Dissociation Constant (pKb)

1.23

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.50

4952-0026 in Drug Discovery

Included in Screening Libraries

Human GPCR Annotated Library (5539 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 4952-0026 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4952-0026?
Check Price and Availability of 4952-0026, 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 4952-0026 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4952-0026
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4952-0026
  • 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 4952-0026 available by request