S632-4981 Screening compound: 6-[3-(1-methanesulfonylpiperidin-4-yl)pyrrolidine-1-carbonyl]quinoline

S632-4981 Screening compound: 6-[3-(1-methanesulfonylpiperidin-4-yl)pyrrolidine-1-carbonyl]quinoline
S632-4981 Screening compound: 6-[3-(1-methanesulfonylpiperidin-4-yl)pyrrolidine-1-carbonyl]quinoline alternative view

Chemical Structure Depiction of ChemDiv screening compound S632-4981
6-[3-(1-methanesulfonylpiperidin-4-yl)pyrrolidine-1-carbonyl]quinoline

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

S632-4981

Molecular Formula

C20H25N3O3S (C20 H25 N3 O3 S)

Compound Name

6-[3-(1-methanesulfonylpiperidin-4-yl)pyrrolidine-1-carbonyl]quinoline

IUPAC name

6-[3-(1-methanesulfonylpiperidin-4-yl)pyrrolidine-1-carbonyl]quinoline

SMILES

CS(N(CC1)CCC1C(CC1)CN1C(c1cc2cccnc2cc1)=O)(=O)=O

InChI

InChI=1S/C20H25N3O3S/c1-27(25,26)23-11-7-15(8-12-23)18-6-10-22(14-18)20(24)17-4-5-19-16(13-17)3-2-9-21-19/h2-5,9,13,15,18H,6-8,10-12,14H2,1H3/t18-/m0/s1

InChI Key

KSIFHDSTKLHKCJ-SFHVURJKSA-N

MDL Number (MFCD)

MFCD29013023

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

387.5

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.661

Distribution Coefficient, logD

1.661

Water Solubility, LogSw

-2.35

Polar Surface Area

57.152

Acid Dissociation Constant (pKa)

24.48

Base Dissociation Constant (pKb)

2.31

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

50.00

S632-4981 in Drug Discovery

Included in Screening Libraries

CNS MPO Library (28609 compounds)

PPI Helix Turn 3D-Mimetics Library (71298 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

Protein-Protein Interaction Library (218420 compounds)

Alpha-Helix Mimetics Library (25899 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Mechanism of action:
  • PPI modulators
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Mimetics
  • Cyclic compounds
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with S632-4981 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S632-4981?
Check Price and Availability of S632-4981, 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 S632-4981 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S632-4981
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S632-4981
  • 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 S632-4981 available by request