F588-0043 Screening compound: 3-{1-[(5-chlorothiophen-2-yl)sulfonyl]-1,2,3,6-tetrahydropyridin-4-yl}-1-[(4-fluorophenyl)methyl]-2-methyl-1H-indole

F588-0043 Screening compound: 3-{1-[(5-chlorothiophen-2-yl)sulfonyl]-1,2,3,6-tetrahydropyridin-4-yl}-1-[(4-fluorophenyl)methyl]-2-methyl-1H-indole
F588-0043 Screening compound: 3-{1-[(5-chlorothiophen-2-yl)sulfonyl]-1,2,3,6-tetrahydropyridin-4-yl}-1-[(4-fluorophenyl)methyl]-2-methyl-1H-indole alternative view

Chemical Structure Depiction of ChemDiv screening compound F588-0043
3-{1-[(5-chlorothiophen-2-yl)sulfonyl]-1,2,3,6-tetrahydropyridin-4-yl}-1-[(4-fluorophenyl)methyl]-2-methyl-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

F588-0043

Molecular Formula

C25H22ClFN2O2S2 (C25 H22 ClFN2 O2 S2)

Compound Name

3-{1-[(5-chlorothiophen-2-yl)sulfonyl]-1,2,3,6-tetrahydropyridin-4-yl}-1-[(4-fluorophenyl)methyl]-2-methyl-1H-indole

IUPAC name

3-{1-[(5-chlorothiophen-2-yl)sulfonyl]-1236-tetrahydropyridin-4-yl}-1-[(4-fluorophenyl)methyl]-2-methyl-1H-indole

SMILES

Cc(n(Cc(cc1)ccc1F)c1c2cccc1)c2C(CC1)=CCN1S(c(s1)ccc1Cl)(=O)=O

InChI

InChI=1S/C25H22ClFN2O2S2/c1-17-25(19-12-14-28(15-13-19)33(30,31)24-11-10-23(26)32-24)21-4-2-3-5-22(21)29(17)16-18-6-8-20(27)9-7-18/h2-12H,13-16H2,1H3

InChI Key

SZLXBAOKLVSIRM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27177540

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

501.05

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

6.403

Distribution Coefficient, logD

6.403

Water Solubility, LogSw

-6.47

Polar Surface Area

33.897

Acid Dissociation Constant (pKa)

26.44

Base Dissociation Constant (pKb)

-4.14

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

References: we are preparing a list of scientific research reports with F588-0043 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F588-0043?
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What is the minimum amount of F588-0043 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F588-0043
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F588-0043
  • 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 F588-0043 available by request