F061-1426 Screening compound: 1-({5-[(1E)-2-(2,5-dimethylphenyl)ethenyl]-3-methyl-1,2-oxazol-4-yl}sulfonyl)-N-(4-methylcyclohexyl)piperidine-3-carboxamide

F061-1426 Screening compound: 1-({5-[(1E)-2-(2,5-dimethylphenyl)ethenyl]-3-methyl-1,2-oxazol-4-yl}sulfonyl)-N-(4-methylcyclohexyl)piperidine-3-carboxamide
F061-1426 Screening compound: 1-({5-[(1E)-2-(2,5-dimethylphenyl)ethenyl]-3-methyl-1,2-oxazol-4-yl}sulfonyl)-N-(4-methylcyclohexyl)piperidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F061-1426
1-({5-[(1E)-2-(2,5-dimethylphenyl)ethenyl]-3-methyl-1,2-oxazol-4-yl}sulfonyl)-N-(4-methylcyclohexyl)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

F061-1426

Molecular Formula

C27H37N3O4S (C27 H37 N3 O4 S)

Compound Name

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

IUPAC name

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

SMILES

CC(CC1)CCC1NC(C(CCC1)CN1S(c1c(/C=C/c2c(C)ccc(C)c2)onc1C)(=O)=O)=O

InChI

InChI=1S/C27H37N3O4S/c1-18-8-12-24(13-9-18)28-27(31)23-6-5-15-30(17-23)35(32,33)26-21(4)29-34-25(26)14-11-22-16-19(2)7-10-20(22)3/h7,10-11,14,16,18,23-24H,5-6,8-9,12-13,15,17H2,1-4H3,(H,28,31)/t18?,23-,24?/m0/s1

InChI Key

CFLSSXBRBCBQES-IMBKEICKSA-N

MDL Number (MFCD)

MFCD14938754

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

499.67

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

5.265

Distribution Coefficient, logD

5.265

Water Solubility, LogSw

-4.91

Polar Surface Area

77.537

Acid Dissociation Constant (pKa)

14.42

Base Dissociation Constant (pKb)

0.39

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

55.60

F061-1426 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

GABA Library (7115 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Eye
Targets:
  • GPCR
  • Ion Channels
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with F061-1426 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F061-1426?
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What is the minimum amount of F061-1426 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F061-1426
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F061-1426
  • 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 F061-1426 available by request