F714-0161 Screening compound: 2-[2-(4-chlorobenzenesulfonyl)-1,2,3,4-tetrahydroisoquinolin-1-yl]-N-cyclopentylacetamide

F714-0161 Screening compound: 2-[2-(4-chlorobenzenesulfonyl)-1,2,3,4-tetrahydroisoquinolin-1-yl]-N-cyclopentylacetamide
F714-0161 Screening compound: 2-[2-(4-chlorobenzenesulfonyl)-1,2,3,4-tetrahydroisoquinolin-1-yl]-N-cyclopentylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F714-0161
2-[2-(4-chlorobenzenesulfonyl)-1,2,3,4-tetrahydroisoquinolin-1-yl]-N-cyclopentylacetamide

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

F714-0161

Molecular Formula

C22H25ClN2O3S (C22 H25 ClN2 O3 S)

Compound Name

2-[2-(4-chlorobenzenesulfonyl)-1,2,3,4-tetrahydroisoquinolin-1-yl]-N-cyclopentylacetamide

IUPAC name

2-[2-(4-chlorobenzenesulfonyl)-1234-tetrahydroisoquinolin-1-yl]-N-cyclopentylacetamide

SMILES

O=C(CC(c1c(CC2)cccc1)N2S(c(cc1)ccc1Cl)(=O)=O)NC1CCCC1

InChI

InChI=1S/C22H25ClN2O3S/c23-17-9-11-19(12-10-17)29(27,28)25-14-13-16-5-1-4-8-20(16)21(25)15-22(26)24-18-6-2-3-7-18/h1,4-5,8-12,18,21H,2-3,6-7,13-15H2,(H,24,26)/t21-/m0/s1

InChI Key

HRHIPIMJDZYUNV-NRFANRHFSA-N

MDL Number (MFCD)

MFCD27187184

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

432.97

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.705

Distribution Coefficient, logD

4.705

Water Solubility, LogSw

-4.96

Polar Surface Area

56.216

Acid Dissociation Constant (pKa)

14.92

Base Dissociation Constant (pKb)

-0.74

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

40.90

F714-0161 in Drug Discovery

Included in Screening Libraries

GPCR Targeted Library (31838 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • 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 F714-0161 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F714-0161?
Check Price and Availability of F714-0161, 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 F714-0161 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F714-0161
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F714-0161
  • 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 F714-0161 available by request