F589-0342 Screening compound: 1-[(3-fluorophenyl)methyl]-2-methyl-3-[1-(5,6,7,8-tetrahydronaphthalene-2-sulfonyl)piperidin-4-yl]-1H-indole

F589-0342 Screening compound: 1-[(3-fluorophenyl)methyl]-2-methyl-3-[1-(5,6,7,8-tetrahydronaphthalene-2-sulfonyl)piperidin-4-yl]-1H-indole
F589-0342 Screening compound: 1-[(3-fluorophenyl)methyl]-2-methyl-3-[1-(5,6,7,8-tetrahydronaphthalene-2-sulfonyl)piperidin-4-yl]-1H-indole alternative view

Chemical Structure Depiction of ChemDiv screening compound F589-0342
1-[(3-fluorophenyl)methyl]-2-methyl-3-[1-(5,6,7,8-tetrahydronaphthalene-2-sulfonyl)piperidin-4-yl]-1H-indole

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

F589-0342

Molecular Formula

C31H33FN2O2S (C31 H33 FN2 O2 S)

Compound Name

1-[(3-fluorophenyl)methyl]-2-methyl-3-[1-(5,6,7,8-tetrahydronaphthalene-2-sulfonyl)piperidin-4-yl]-1H-indole

IUPAC name

1-[(3-fluorophenyl)methyl]-2-methyl-3-[1-(5678-tetrahydronaphthalene-2-sulfonyl)piperidin-4-yl]-1H-indole

SMILES

Cc1c(C(CC2)CCN2S(c2cc(CCCC3)c3cc2)(=O)=O)c(cccc2)c2n1Cc1cc(F)ccc1

InChI

InChI=1S/C31H33FN2O2S/c1-22-31(29-11-4-5-12-30(29)34(22)21-23-7-6-10-27(32)19-23)25-15-17-33(18-16-25)37(35,36)28-14-13-24-8-2-3-9-26(24)20-28/h4-7,10-14,19-20,25H,2-3,8-9,15-18,21H2,1H3

InChI Key

JAXOBUOCCUDTAG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14960285

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

516.68

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

7.378

Distribution Coefficient, logD

7.378

Water Solubility, LogSw

-6.02

Polar Surface Area

32.799

Acid Dissociation Constant (pKa)

24.58

Base Dissociation Constant (pKb)

-2.31

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.50

F589-0342 in Drug Discovery

Included in Screening Libraries

DGK Inhibitors Library (10558 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with F589-0342 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F589-0342?
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What is the minimum amount of F589-0342 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F589-0342
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F589-0342
  • 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 F589-0342 available by request