5979-0337 Screening compound: 1-(4-methylbenzenesulfonyl)-3-(pyrrolidine-1-carbonyl)piperidine

5979-0337 Screening compound: 1-(4-methylbenzenesulfonyl)-3-(pyrrolidine-1-carbonyl)piperidine
5979-0337 Screening compound: 1-(4-methylbenzenesulfonyl)-3-(pyrrolidine-1-carbonyl)piperidine alternative view

Chemical Structure Depiction of ChemDiv screening compound 5979-0337
1-(4-methylbenzenesulfonyl)-3-(pyrrolidine-1-carbonyl)piperidine

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

5979-0337

Molecular Formula

C17H24N2O3S (C17 H24 N2 O3 S)

Compound Name

1-(4-methylbenzenesulfonyl)-3-(pyrrolidine-1-carbonyl)piperidine

IUPAC name

1-(4-methylbenzenesulfonyl)-3-(pyrrolidine-1-carbonyl)piperidine

SMILES

Cc(cc1)ccc1S(N(CCC1)CC1C(N1CCCC1)=O)(=O)=O

InChI

InChI=1S/C17H24N2O3S/c1-14-6-8-16(9-7-14)23(21,22)19-12-4-5-15(13-19)17(20)18-10-2-3-11-18/h6-9,15H,2-5,10-13H2,1H3/t15-/m0/s1

InChI Key

ZBIBRXPQGRMQLK-HNNXBMFYSA-N

MDL Number (MFCD)

MFCD03615903

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

336.46

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.419

Distribution Coefficient, logD

2.419

Water Solubility, LogSw

-2.60

Polar Surface Area

48.897

Acid Dissociation Constant (pKa)

22.98

Base Dissociation Constant (pKb)

-2.36

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

58.80

5979-0337 in Drug Discovery

Included in Screening Libraries

GPCR Targeted Library (31838 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • GPCR
  • Proteases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 5979-0337 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5979-0337?
Check Price and Availability of 5979-0337, 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 5979-0337 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5979-0337
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5979-0337
  • 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 5979-0337 available by request