8019-3939 Screening compound: 1-(4-chlorobenzenesulfonyl)-N-(pyridin-2-yl)pyrrolidine-2-carboxamide

8019-3939 Screening compound: 1-(4-chlorobenzenesulfonyl)-N-(pyridin-2-yl)pyrrolidine-2-carboxamide
8019-3939 Screening compound: 1-(4-chlorobenzenesulfonyl)-N-(pyridin-2-yl)pyrrolidine-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8019-3939
1-(4-chlorobenzenesulfonyl)-N-(pyridin-2-yl)pyrrolidine-2-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

8019-3939

Molecular Formula

C16H16ClN3O3S (C16 H16 ClN3 O3 S)

Compound Name

1-(4-chlorobenzenesulfonyl)-N-(pyridin-2-yl)pyrrolidine-2-carboxamide

IUPAC name

1-(4-chlorobenzenesulfonyl)-N-(pyridin-2-yl)pyrrolidine-2-carboxamide

SMILES

O=C(C(CCC1)N1S(c(cc1)ccc1Cl)(=O)=O)Nc1ncccc1

InChI

InChI=1S/C16H16ClN3O3S/c17-12-6-8-13(9-7-12)24(22,23)20-11-3-4-14(20)16(21)19-15-5-1-2-10-18-15/h1-2,5-10,14H,3-4,11H2,(H,18,19,21)/t14-/m0/s1

InChI Key

LEFJAVFMQAIBPT-AWEZNQCLSA-N

MDL Number (MFCD)

MFCD07633913

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

365.84

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.656

Distribution Coefficient, logD

2.653

Water Solubility, LogSw

-3.48

Polar Surface Area

65.492

Acid Dissociation Constant (pKa)

9.47

Base Dissociation Constant (pKb)

3.33

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

25.00

8019-3939 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Anti-Inflammatory Library (24602 compounds)

Antiviral HBV Library (10007 compounds)

Antiviral Library (67538 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Dark Chemical Matter Library (18430 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

Anti-HIV1 Library (19540 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
  • Pool
Therapeutical areas:
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
  • Antiviral
  • Infections
  • Immune system
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 8019-3939 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8019-3939?
Check Price and Availability of 8019-3939, 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 8019-3939 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8019-3939
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8019-3939
  • 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 8019-3939 available by request