V011-2796 Screening compound: 4-(5-methyl-1H-indol-3-yl)piperidino [3-(trifluoromethoxy)phenyl] sulfone

V011-2796 Screening compound: 4-(5-methyl-1H-indol-3-yl)piperidino [3-(trifluoromethoxy)phenyl] sulfone
V011-2796 Screening compound: 4-(5-methyl-1H-indol-3-yl)piperidino [3-(trifluoromethoxy)phenyl] sulfone alternative view

Chemical Structure Depiction of ChemDiv screening compound V011-2796
4-(5-methyl-1H-indol-3-yl)piperidino [3-(trifluoromethoxy)phenyl] sulfone

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

V011-2796

Molecular Formula

C21H21F3N2O3S (C21 H21 F3 N2 O3 S)

Compound Name

4-(5-methyl-1H-indol-3-yl)piperidino [3-(trifluoromethoxy)phenyl] sulfone

IUPAC name

5-methyl-3-{1-[3-(trifluoromethoxy)benzenesulfonyl]piperidin-4-yl}-1H-indole

SMILES

Cc(cc1)cc2c1[nH]cc2C(CC1)CCN1S(c1cc(OC(F)(F)F)ccc1)(=O)=O

InChI

InChI=1S/C21H21F3N2O3S/c1-14-5-6-20-18(11-14)19(13-25-20)15-7-9-26(10-8-15)30(27,28)17-4-2-3-16(12-17)29-21(22,23)24/h2-6,11-13,15,25H,7-10H2,1H3

InChI Key

MTJJIRWFACIPGZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19966381

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

438.47

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.539

Distribution Coefficient, logD

5.539

Water Solubility, LogSw

-5.61

Polar Surface Area

47.485

Acid Dissociation Constant (pKa)

18.64

Base Dissociation Constant (pKb)

-2.61

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.33

V011-2796 in Drug Discovery

Included in Screening Libraries

DGK Inhibitors Library (10558 compounds)

Indole Derivatives (10091 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Kinases
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with V011-2796 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V011-2796?
Check Price and Availability of V011-2796, 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 V011-2796 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V011-2796
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V011-2796
  • 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 V011-2796 available by request