Screening compound: C21H27F3N4O3S (S954-0411)

Screening compound: C<sub>21</sub>H<sub>27</sub>F<sub>3</sub>N<sub>4</sub>O<sub>3</sub>S (S954-0411)
Screening compound: C<sub>21</sub>H<sub>27</sub>F<sub>3</sub>N<sub>4</sub>O<sub>3</sub>S (S954-0411) alternative view

Chemical Structure Depiction of ChemDiv screening compound
C21H27F3N4O3S (S954-0411)

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

S954-0411

Molecular Formula

C21H27F3N4O3S (C21 H27 F3 N4 O3 S)

Compound Name

(3S,4S)-4-{1-[4-cyano-3-(trifluoromethyl)phenyl]-4-piperidyl}-N,N-dimethyl-1-(methylsulfonyl)tetrahydro-1H-pyrrole-3-carboxamide

IUPAC name

(3S4S)-4-{1-[4-cyano-3-(trifluoromethyl)phenyl]piperidin-4-yl}-1-methanesulfonyl-NN-dimethylpyrrolidine-3-carboxamide

SMILES

CN(C)C([C@@H](CN(C1)S(C)(=O)=O)[C@H]1C(CC1)CCN1c(cc1)cc(C(F)(F)F)c1C#N)=O

InChI

InChI=1S/C21H27F3N4O3S/c1-26(2)20(29)18-13-28(32(3,30)31)12-17(18)14-6-8-27(9-7-14)16-5-4-15(11-25)19(10-16)21(22,23)24/h4-5,10,14,17-18H,6-9,12-13H2,1-3H3/t17-,18+/m0/s1

InChI Key

RITKOOVBRKFEKI-ZWKOTPCHSA-N

MDL Number (MFCD)

C21H27F3N4O3S (S954-0411) in Drug Discovery

Included in Screening Libraries

Androgen Receptor Antagonists Library (4240 compounds)

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

PPI Helix Turn 3D-Mimetics Library (71298 compounds)

Protein-Protein Interaction Library (218420 compounds)

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Male
  • Skin
  • Endocrine
Targets:
  • Nuclear receptors
Mechanism of action:
  • Receptor's ligands
  • PPI modulators
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Mimetics

References: we are preparing a list of scientific research reports with C21H27F3N4O3S (S954-0411) chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C21H27F3N4O3S (S954-0411)?
Check Price and Availability of C21H27F3N4O3S (S954-0411), 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 C21H27F3N4O3S (S954-0411) you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C21H27F3N4O3S (S954-0411)
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C21H27F3N4O3S (S954-0411)
  • 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 C21H27F3N4O3S (S954-0411) available by request