5641-1707 Screening compound: 1-(4-bromobenzenesulfonyl)-N-[(pyridin-2-yl)methyl]piperidine-4-carboxamide

5641-1707 Screening compound: 1-(4-bromobenzenesulfonyl)-N-[(pyridin-2-yl)methyl]piperidine-4-carboxamide
5641-1707 Screening compound: 1-(4-bromobenzenesulfonyl)-N-[(pyridin-2-yl)methyl]piperidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 5641-1707
1-(4-bromobenzenesulfonyl)-N-[(pyridin-2-yl)methyl]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

5641-1707

Molecular Formula

C18H20BrN3O3S (C18 H20 BrN3 O3 S)

Compound Name

1-(4-bromobenzenesulfonyl)-N-[(pyridin-2-yl)methyl]piperidine-4-carboxamide

IUPAC name

1-(4-bromobenzenesulfonyl)-N-[(pyridin-2-yl)methyl]piperidine-4-carboxamide

SMILES

O=C(C(CC1)CCN1S(c(cc1)ccc1Br)(=O)=O)NCc1ncccc1

InChI

InChI=1S/C18H20BrN3O3S/c19-15-4-6-17(7-5-15)26(24,25)22-11-8-14(9-12-22)18(23)21-13-16-3-1-2-10-20-16/h1-7,10,14H,8-9,11-13H2,(H,21,23)

InChI Key

VFNPGGZQYMOODS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03269573

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

438.35

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.359

Distribution Coefficient, logD

2.359

Water Solubility, LogSw

-2.66

Polar Surface Area

65.906

Acid Dissociation Constant (pKa)

12.37

Base Dissociation Constant (pKb)

3.72

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

5641-1707 in Drug Discovery

Included in Screening Libraries

Dark Chemical Matter Library (18430 compounds)

Selective Target Activity Profiling Library (14702 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool
Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Proteases
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 5641-1707 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5641-1707?
Check Price and Availability of 5641-1707, 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 5641-1707 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5641-1707
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5641-1707
  • 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 5641-1707 available by request