F916-0890 Screening compound: N-[(4-bromophenyl)methyl]-3,4-dimethyl-N-[2-oxo-2-(piperazin-1-yl)ethyl]benzene-1-sulfonamide

F916-0890 Screening compound: N-[(4-bromophenyl)methyl]-3,4-dimethyl-N-[2-oxo-2-(piperazin-1-yl)ethyl]benzene-1-sulfonamide
F916-0890 Screening compound: N-[(4-bromophenyl)methyl]-3,4-dimethyl-N-[2-oxo-2-(piperazin-1-yl)ethyl]benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F916-0890
N-[(4-bromophenyl)methyl]-3,4-dimethyl-N-[2-oxo-2-(piperazin-1-yl)ethyl]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

F916-0890

Molecular Formula

C21H26BrN3O3S (C21 H26 BrN3 O3 S)

Compound Name

N-[(4-bromophenyl)methyl]-3,4-dimethyl-N-[2-oxo-2-(piperazin-1-yl)ethyl]benzene-1-sulfonamide

IUPAC name

N-[(4-bromophenyl)methyl]-34-dimethyl-N-[2-oxo-2-(piperazin-1-yl)ethyl]benzene-1-sulfonamide

SMILES

Cc(cc1)c(C)cc1S(N(CC(N1CCNCC1)=O)Cc(cc1)ccc1Br)(=O)=O

InChI

InChI=1S/C21H26BrN3O3S/c1-16-3-8-20(13-17(16)2)29(27,28)25(14-18-4-6-19(22)7-5-18)15-21(26)24-11-9-23-10-12-24/h3-8,13,23H,9-12,14-15H2,1-2H3

InChI Key

CBHKVCQTUFTWGV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27204283

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

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.290

Distribution Coefficient, logD

2.730

Water Solubility, LogSw

-3.62

Polar Surface Area

59.695

Acid Dissociation Constant (pKa)

21.02

Base Dissociation Constant (pKb)

7.82

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.10

References: we are preparing a list of scientific research reports with F916-0890 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F916-0890?
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What is the minimum amount of F916-0890 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F916-0890
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F916-0890
  • 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 F916-0890 available by request