F916-0604 Screening compound: 4-bromo-N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-[3-(propan-2-yloxy)propyl]benzene-1-sulfonamide

F916-0604 Screening compound: 4-bromo-N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-[3-(propan-2-yloxy)propyl]benzene-1-sulfonamide
F916-0604 Screening compound: 4-bromo-N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-[3-(propan-2-yloxy)propyl]benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F916-0604
4-bromo-N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-[3-(propan-2-yloxy)propyl]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

F916-0604

Molecular Formula

C18H28BrN3O4S (C18 H28 BrN3 O4 S)

Compound Name

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

IUPAC name

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

SMILES

CC(C)OCCCN(CC(N1CCNCC1)=O)S(c(cc1)ccc1Br)(=O)=O

InChI

InChI=1S/C18H28BrN3O4S/c1-15(2)26-13-3-10-22(14-18(23)21-11-8-20-9-12-21)27(24,25)17-6-4-16(19)5-7-17/h4-7,15,20H,3,8-14H2,1-2H3

InChI Key

PVNIOIVWUDYZHH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27204190

Chemical and Physical Properties

Saltdata

CF3COOH

Molecular Weight

462.41

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

1.421

Distribution Coefficient, logD

0.862

Water Solubility, LogSw

-2.46

Polar Surface Area

67.146

Acid Dissociation Constant (pKa)

23.02

Base Dissociation Constant (pKb)

7.82

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

61.10

F916-0604 in Drug Discovery

Included in Screening Libraries

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with F916-0604 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F916-0604?
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What is the minimum amount of F916-0604 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F916-0604
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F916-0604
  • 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 F916-0604 available by request