F916-0612 Screening compound: 4-bromo-N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-(3-phenylpropyl)benzene-1-sulfonamide

F916-0612 Screening compound: 4-bromo-N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-(3-phenylpropyl)benzene-1-sulfonamide
F916-0612 Screening compound: 4-bromo-N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-(3-phenylpropyl)benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F916-0612
4-bromo-N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-(3-phenylpropyl)benzene-1-sulfonamide

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

F916-0612

Molecular Formula

C21H26BrN3O3S (C21 H26 BrN3 O3 S)

Compound Name

4-bromo-N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-(3-phenylpropyl)benzene-1-sulfonamide

IUPAC name

4-bromo-N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-(3-phenylpropyl)benzene-1-sulfonamide

SMILES

O=C(CN(CCCc1ccccc1)S(c(cc1)ccc1Br)(=O)=O)N1CCNCC1

InChI

InChI=1S/C21H26BrN3O3S/c22-19-8-10-20(11-9-19)29(27,28)25(14-4-7-18-5-2-1-3-6-18)17-21(26)24-15-12-23-13-16-24/h1-3,5-6,8-11,23H,4,7,12-17H2

InChI Key

ZMDFYDIDVUUTND-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27204196

Chemical and Physical Properties

Saltdata

CF3COOH

Molecular Weight

480.43

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.994

Distribution Coefficient, logD

2.435

Water Solubility, LogSw

-3.52

Polar Surface Area

59.674

Acid Dissociation Constant (pKa)

23.02

Base Dissociation Constant (pKb)

7.82

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.10

F916-0612 in Drug Discovery

Included in Screening Libraries

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 F916-0612 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F916-0612?
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What is the minimum amount of F916-0612 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F916-0612
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F916-0612
  • 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 F916-0612 available by request