F061-1421 Screening compound: N-(3-cyanophenyl)-1-({5-[(1E)-2-(2,5-dimethylphenyl)ethenyl]-3-methyl-1,2-oxazol-4-yl}sulfonyl)piperidine-3-carboxamide

F061-1421 Screening compound: N-(3-cyanophenyl)-1-({5-[(1E)-2-(2,5-dimethylphenyl)ethenyl]-3-methyl-1,2-oxazol-4-yl}sulfonyl)piperidine-3-carboxamide
F061-1421 Screening compound: N-(3-cyanophenyl)-1-({5-[(1E)-2-(2,5-dimethylphenyl)ethenyl]-3-methyl-1,2-oxazol-4-yl}sulfonyl)piperidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F061-1421
N-(3-cyanophenyl)-1-({5-[(1E)-2-(2,5-dimethylphenyl)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

F061-1421

Molecular Formula

C27H28N4O4S (C27 H28 N4 O4 S)

Compound Name

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

IUPAC name

N-(3-cyanophenyl)-1-({5-[(1E)-2-(25-dimethylphenyl)ethenyl]-3-methyl-12-oxazol-4-yl}sulfonyl)piperidine-3-carboxamide

SMILES

Cc1noc(/C=C/c2c(C)ccc(C)c2)c1S(N(CCC1)CC1C(Nc1cc(C#N)ccc1)=O)(=O)=O

InChI

InChI=1S/C27H28N4O4S/c1-18-9-10-19(2)22(14-18)11-12-25-26(20(3)30-35-25)36(33,34)31-13-5-7-23(17-31)27(32)29-24-8-4-6-21(15-24)16-28/h4,6,8-12,14-15,23H,5,7,13,17H2,1-3H3,(H,29,32)/t23-/m0/s1

InChI Key

REHNCEMETWXRPF-QHCPKHFHSA-N

MDL Number (MFCD)

MFCD14938752

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

504.61

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.177

Distribution Coefficient, logD

4.175

Water Solubility, LogSw

-4.18

Polar Surface Area

93.546

Acid Dissociation Constant (pKa)

9.64

Base Dissociation Constant (pKb)

-1.84

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

29.60

F061-1421 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 F061-1421 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F061-1421?
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What is the minimum amount of F061-1421 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F061-1421
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F061-1421
  • 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 F061-1421 available by request