F819-0408 Screening compound: 1-(4-{5-[(3-chloro-4-methoxyphenyl)methyl]-1,2,4-oxadiazol-3-yl}benzenesulfonyl)-4-methylpiperidine

F819-0408 Screening compound: 1-(4-{5-[(3-chloro-4-methoxyphenyl)methyl]-1,2,4-oxadiazol-3-yl}benzenesulfonyl)-4-methylpiperidine
F819-0408 Screening compound: 1-(4-{5-[(3-chloro-4-methoxyphenyl)methyl]-1,2,4-oxadiazol-3-yl}benzenesulfonyl)-4-methylpiperidine alternative view

Chemical Structure Depiction of ChemDiv screening compound F819-0408
1-(4-{5-[(3-chloro-4-methoxyphenyl)methyl]-1,2,4-oxadiazol-3-yl}benzenesulfonyl)-4-methylpiperidine

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

F819-0408

Molecular Formula

C22H24ClN3O4S (C22 H24 ClN3 O4 S)

Compound Name

1-(4-{5-[(3-chloro-4-methoxyphenyl)methyl]-1,2,4-oxadiazol-3-yl}benzenesulfonyl)-4-methylpiperidine

IUPAC name

1-(4-{5-[(3-chloro-4-methoxyphenyl)methyl]-124-oxadiazol-3-yl}benzenesulfonyl)-4-methylpiperidine

SMILES

CC(CC1)CCN1S(c(cc1)ccc1-c1noc(Cc(cc2)cc(Cl)c2OC)n1)(=O)=O

InChI

InChI=1S/C22H24ClN3O4S/c1-15-9-11-26(12-10-15)31(27,28)18-6-4-17(5-7-18)22-24-21(30-25-22)14-16-3-8-20(29-2)19(23)13-16/h3-8,13,15H,9-12,14H2,1-2H3

InChI Key

VCWDMRYCYLVNFQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27195409

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

461.97

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.192

Distribution Coefficient, logD

5.192

Water Solubility, LogSw

-5.81

Polar Surface Area

70.651

Acid Dissociation Constant (pKa)

26.32

Base Dissociation Constant (pKb)

-4.22

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.40

F819-0408 in Drug Discovery

Included in Screening Libraries

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

KRAS-Targeted Library (16000 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with F819-0408 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F819-0408?
Check Price and Availability of F819-0408, 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 F819-0408 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F819-0408
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F819-0408
  • 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 F819-0408 available by request