K783-6523 Screening compound: 1-(4-methylbenzenesulfonyl)-N-[(4-methylphenyl)methyl]-1,2,3,6-tetrahydropyridine-4-carboxamide

K783-6523 Screening compound: 1-(4-methylbenzenesulfonyl)-N-[(4-methylphenyl)methyl]-1,2,3,6-tetrahydropyridine-4-carboxamide
K783-6523 Screening compound: 1-(4-methylbenzenesulfonyl)-N-[(4-methylphenyl)methyl]-1,2,3,6-tetrahydropyridine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K783-6523
1-(4-methylbenzenesulfonyl)-N-[(4-methylphenyl)methyl]-1,2,3,6-tetrahydropyridine-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

K783-6523

Molecular Formula

C21H24N2O3S (C21 H24 N2 O3 S)

Compound Name

1-(4-methylbenzenesulfonyl)-N-[(4-methylphenyl)methyl]-1,2,3,6-tetrahydropyridine-4-carboxamide

IUPAC name

1-(4-methylbenzenesulfonyl)-N-[(4-methylphenyl)methyl]-1236-tetrahydropyridine-4-carboxamide

SMILES

Cc1ccc(CNC(C(CC2)=CCN2S(c2ccc(C)cc2)(=O)=O)=O)cc1

InChI

InChI=1S/C21H24N2O3S/c1-16-3-7-18(8-4-16)15-22-21(24)19-11-13-23(14-12-19)27(25,26)20-9-5-17(2)6-10-20/h3-11H,12-15H2,1-2H3,(H,22,24)

InChI Key

IFWWZKFYXGISSW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15096446

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

384.5

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.881

Distribution Coefficient, logD

3.881

Water Solubility, LogSw

-3.84

Polar Surface Area

56.363

Acid Dissociation Constant (pKa)

11.46

Base Dissociation Constant (pKb)

1.89

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.60

K783-6523 in Drug Discovery

Included in Screening Libraries

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 K783-6523 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K783-6523?
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What is the minimum amount of K783-6523 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K783-6523
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K783-6523
  • 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 K783-6523 available by request