F744-0131 Screening compound: 3-cyclopentyl-N-{2-[4-(4-methoxybenzenesulfonyl)piperazin-1-yl]ethyl}propanamide

F744-0131 Screening compound: 3-cyclopentyl-N-{2-[4-(4-methoxybenzenesulfonyl)piperazin-1-yl]ethyl}propanamide
F744-0131 Screening compound: 3-cyclopentyl-N-{2-[4-(4-methoxybenzenesulfonyl)piperazin-1-yl]ethyl}propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F744-0131
3-cyclopentyl-N-{2-[4-(4-methoxybenzenesulfonyl)piperazin-1-yl]ethyl}propanamide

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

F744-0131

Molecular Formula

C21H33N3O4S (C21 H33 N3 O4 S)

Compound Name

3-cyclopentyl-N-{2-[4-(4-methoxybenzenesulfonyl)piperazin-1-yl]ethyl}propanamide

IUPAC name

3-cyclopentyl-N-{2-[4-(4-methoxybenzenesulfonyl)piperazin-1-yl]ethyl}propanamide

SMILES

COc(cc1)ccc1S(N1CCN(CCNC(CCC2CCCC2)=O)CC1)(=O)=O

InChI

InChI=1S/C21H33N3O4S/c1-28-19-7-9-20(10-8-19)29(26,27)24-16-14-23(15-17-24)13-12-22-21(25)11-6-18-4-2-3-5-18/h7-10,18H,2-6,11-17H2,1H3,(H,22,25)

InChI Key

MSVXWOILGONLPV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14083565

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

423.58

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.250

Distribution Coefficient, logD

2.242

Water Solubility, LogSw

-2.79

Polar Surface Area

67.883

Acid Dissociation Constant (pKa)

13.80

Base Dissociation Constant (pKb)

5.68

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

66.70

F744-0131 in Drug Discovery

Included in Screening Libraries

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

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with F744-0131 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F744-0131?
Check Price and Availability of F744-0131, 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 F744-0131 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F744-0131
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F744-0131
  • 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 F744-0131 available by request