F061-0884 Screening compound: N-(4-chloro-2-methylphenyl)-1-({5-[(1E)-2-(2-fluorophenyl)ethenyl]-3-methyl-1,2-oxazol-4-yl}sulfonyl)piperidine-3-carboxamide

F061-0884 Screening compound: N-(4-chloro-2-methylphenyl)-1-({5-[(1E)-2-(2-fluorophenyl)ethenyl]-3-methyl-1,2-oxazol-4-yl}sulfonyl)piperidine-3-carboxamide
F061-0884 Screening compound: N-(4-chloro-2-methylphenyl)-1-({5-[(1E)-2-(2-fluorophenyl)ethenyl]-3-methyl-1,2-oxazol-4-yl}sulfonyl)piperidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F061-0884
N-(4-chloro-2-methylphenyl)-1-({5-[(1E)-2-(2-fluorophenyl)ethenyl]-3-methyl-1,2-oxazol-4-yl}sulfonyl)piperidine-3-carboxamide

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

F061-0884

Molecular Formula

C25H25ClFN3O4S (C25 H25 ClFN3 O4 S)

Compound Name

N-(4-chloro-2-methylphenyl)-1-({5-[(1E)-2-(2-fluorophenyl)ethenyl]-3-methyl-1,2-oxazol-4-yl}sulfonyl)piperidine-3-carboxamide

IUPAC name

N-(4-chloro-2-methylphenyl)-1-({5-[(1E)-2-(2-fluorophenyl)ethenyl]-3-methyl-12-oxazol-4-yl}sulfonyl)piperidine-3-carboxamide

SMILES

Cc1noc(/C=C/c(cccc2)c2F)c1S(N(CCC1)CC1C(Nc(cc1)c(C)cc1Cl)=O)(=O)=O

InChI

InChI=1S/C25H25ClFN3O4S/c1-16-14-20(26)10-11-22(16)28-25(31)19-7-5-13-30(15-19)35(32,33)24-17(2)29-34-23(24)12-9-18-6-3-4-8-21(18)27/h3-4,6,8-12,14,19H,5,7,13,15H2,1-2H3,(H,28,31)/t19-/m0/s1

InChI Key

AHEUTZWFQBWEOM-IBGZPJMESA-N

MDL Number (MFCD)

MFCD14938691

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

518.01

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.679

Distribution Coefficient, logD

4.675

Water Solubility, LogSw

-4.81

Polar Surface Area

75.792

Acid Dissociation Constant (pKa)

9.42

Base Dissociation Constant (pKb)

-1.08

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

28.00

F061-0884 in Drug Discovery

Included in Screening Libraries

Protein Arginine Methyltransferases Library (27925 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with F061-0884 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F061-0884?
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What is the minimum amount of F061-0884 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F061-0884
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F061-0884
  • 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 F061-0884 available by request