K786-4459 Screening compound: N-benzyl-1-[1-(4-methylbenzenesulfonyl)piperidine-4-carbonyl]piperidine-4-carboxamide

K786-4459 Screening compound: N-benzyl-1-[1-(4-methylbenzenesulfonyl)piperidine-4-carbonyl]piperidine-4-carboxamide
K786-4459 Screening compound: N-benzyl-1-[1-(4-methylbenzenesulfonyl)piperidine-4-carbonyl]piperidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K786-4459
N-benzyl-1-[1-(4-methylbenzenesulfonyl)piperidine-4-carbonyl]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

K786-4459

Molecular Formula

C26H33N3O4S (C26 H33 N3 O4 S)

Compound Name

N-benzyl-1-[1-(4-methylbenzenesulfonyl)piperidine-4-carbonyl]piperidine-4-carboxamide

IUPAC name

N-benzyl-1-[1-(4-methylbenzenesulfonyl)piperidine-4-carbonyl]piperidine-4-carboxamide

SMILES

Cc(cc1)ccc1S(N(CC1)CCC1C(N(CC1)CCC1C(NCc1ccccc1)=O)=O)(=O)=O

InChI

InChI=1S/C26H33N3O4S/c1-20-7-9-24(10-8-20)34(32,33)29-17-13-23(14-18-29)26(31)28-15-11-22(12-16-28)25(30)27-19-21-5-3-2-4-6-21/h2-10,22-23H,11-19H2,1H3,(H,27,30)

InChI Key

CSELBGPSCNEAOX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03832084

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

483.63

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.776

Distribution Coefficient, logD

2.776

Water Solubility, LogSw

-3.24

Polar Surface Area

73.011

Acid Dissociation Constant (pKa)

12.56

Base Dissociation Constant (pKb)

7.05

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

46.20

K786-4459 in Drug Discovery

Included in Screening Libraries

CORONAVIRUS Library (20774 compounds)

MCL1 Targeted Library (12200 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic

References: we are preparing a list of scientific research reports with K786-4459 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K786-4459?
Check Price and Availability of K786-4459, 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 K786-4459 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K786-4459
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K786-4459
  • 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 K786-4459 available by request