C072-0244 Screening compound: 2-[(4-chlorophenyl)sulfanyl]-4-(pyrrolidine-1-carbonyl)quinoline

C072-0244 Screening compound: 2-[(4-chlorophenyl)sulfanyl]-4-(pyrrolidine-1-carbonyl)quinoline
C072-0244 Screening compound: 2-[(4-chlorophenyl)sulfanyl]-4-(pyrrolidine-1-carbonyl)quinoline alternative view

Chemical Structure Depiction of ChemDiv screening compound C072-0244
2-[(4-chlorophenyl)sulfanyl]-4-(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

C072-0244

Molecular Formula

C20H17ClN2OS (C20 H17 ClN2 OS)

Compound Name

2-[(4-chlorophenyl)sulfanyl]-4-(pyrrolidine-1-carbonyl)quinoline

IUPAC name

2-[(4-chlorophenyl)sulfanyl]-4-(pyrrolidine-1-carbonyl)quinoline

SMILES

O=C(c1cc(Sc(cc2)ccc2Cl)nc2ccccc12)N1CCCC1

InChI

InChI=1S/C20H17ClN2OS/c21-14-7-9-15(10-8-14)25-19-13-17(20(24)23-11-3-4-12-23)16-5-1-2-6-18(16)22-19/h1-2,5-10,13H,3-4,11-12H2

InChI Key

TXTCPKYRUUEDPY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14716665

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

368.89

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.439

Distribution Coefficient, logD

5.439

Water Solubility, LogSw

-6.06

Polar Surface Area

24.673

Acid Dissociation Constant (pKa)

26.87

Base Dissociation Constant (pKb)

1.75

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

C072-0244 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

GPCR Targeted Library (31838 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with C072-0244 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C072-0244?
Check Price and Availability of C072-0244, 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 C072-0244 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C072-0244
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C072-0244
  • 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 C072-0244 available by request