C274-0496 Screening compound: 1-{1-[(5-bromothiophen-2-yl)sulfonyl]piperidine-4-carbonyl}-4-[3-(trifluoromethyl)phenyl]piperazine

C274-0496 Screening compound: 1-{1-[(5-bromothiophen-2-yl)sulfonyl]piperidine-4-carbonyl}-4-[3-(trifluoromethyl)phenyl]piperazine
C274-0496 Screening compound: 1-{1-[(5-bromothiophen-2-yl)sulfonyl]piperidine-4-carbonyl}-4-[3-(trifluoromethyl)phenyl]piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound C274-0496
1-{1-[(5-bromothiophen-2-yl)sulfonyl]piperidine-4-carbonyl}-4-[3-(trifluoromethyl)phenyl]piperazine

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

C274-0496

Molecular Formula

C21H23BrF3N3O3S2 (C21 H23 BrF3 N3 O3 S2)

Compound Name

1-{1-[(5-bromothiophen-2-yl)sulfonyl]piperidine-4-carbonyl}-4-[3-(trifluoromethyl)phenyl]piperazine

IUPAC name

1-{1-[(5-bromothiophen-2-yl)sulfonyl]piperidine-4-carbonyl}-4-[3-(trifluoromethyl)phenyl]piperazine

SMILES

O=C(C(CC1)CCN1S(c(s1)ccc1Br)(=O)=O)N(CC1)CCN1c1cc(C(F)(F)F)ccc1

InChI

InChI=1S/C21H23BrF3N3O3S2/c22-18-4-5-19(32-18)33(30,31)28-8-6-15(7-9-28)20(29)27-12-10-26(11-13-27)17-3-1-2-16(14-17)21(23,24)25/h1-5,14-15H,6-13H2

InChI Key

BYKFTMFWCLSCJS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14740152

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

566.46

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.313

Distribution Coefficient, logD

4.313

Water Solubility, LogSw

-4.34

Polar Surface Area

52.876

Acid Dissociation Constant (pKa)

23.63

Base Dissociation Constant (pKb)

6.01

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

47.60

C274-0496 in Drug Discovery

Included in Screening Libraries

Human Proteases Annotated Library (2868 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C274-0496 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C274-0496?
Check Price and Availability of C274-0496, 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 C274-0496 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C274-0496
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C274-0496
  • 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 C274-0496 available by request