V009-4547 Screening compound: 2,4-dichloro-5-methylphenyl [4-(5-fluoro-1H-indol-3-yl)piperidino] sulfone

V009-4547 Screening compound: 2,4-dichloro-5-methylphenyl [4-(5-fluoro-1H-indol-3-yl)piperidino] sulfone
V009-4547 Screening compound: 2,4-dichloro-5-methylphenyl [4-(5-fluoro-1H-indol-3-yl)piperidino] sulfone alternative view

Chemical Structure Depiction of ChemDiv screening compound V009-4547
2,4-dichloro-5-methylphenyl [4-(5-fluoro-1H-indol-3-yl)piperidino] 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

V009-4547

Molecular Formula

C20H19Cl2FN2O2S (C20 H19 Cl2 FN2 O2 S)

Compound Name

2,4-dichloro-5-methylphenyl [4-(5-fluoro-1H-indol-3-yl)piperidino] sulfone

IUPAC name

3-[1-(24-dichloro-5-methylbenzenesulfonyl)piperidin-4-yl]-5-fluoro-1H-indole

SMILES

Cc(c(Cl)c1)cc(S(N(CC2)CCC2c2c[nH]c(cc3)c2cc3F)(=O)=O)c1Cl

InChI

InChI=1S/C20H19Cl2FN2O2S/c1-12-8-20(18(22)10-17(12)21)28(26,27)25-6-4-13(5-7-25)16-11-24-19-3-2-14(23)9-15(16)19/h2-3,8-11,13,24H,4-7H2,1H3

InChI Key

HOAYUKABZHCCND-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19966394

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

441.35

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.764

Distribution Coefficient, logD

5.764

Water Solubility, LogSw

-6.08

Polar Surface Area

41.549

Acid Dissociation Constant (pKa)

18.33

Base Dissociation Constant (pKb)

-3.37

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

V009-4547 in Drug Discovery

Included in Screening Libraries

DGK Inhibitors Library (10558 compounds)

Immunological Library (6760 compounds)

Indole Derivatives (10091 compounds)

Indoleamine 2,3-dioxygenase 1 Focused Library (5816 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with V009-4547 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V009-4547?
Check Price and Availability of V009-4547, 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 V009-4547 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V009-4547
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V009-4547
  • 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 V009-4547 available by request