C094-1736 Screening compound: N-cyclohexyl-2-{N-[(furan-2-yl)methyl]-2-(thiophen-2-yl)acetamido}-2-methylbutanamide

C094-1736 Screening compound: N-cyclohexyl-2-{N-[(furan-2-yl)methyl]-2-(thiophen-2-yl)acetamido}-2-methylbutanamide
C094-1736 Screening compound: N-cyclohexyl-2-{N-[(furan-2-yl)methyl]-2-(thiophen-2-yl)acetamido}-2-methylbutanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C094-1736
N-cyclohexyl-2-{N-[(furan-2-yl)methyl]-2-(thiophen-2-yl)acetamido}-2-methylbutanamide

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

C094-1736

Molecular Formula

C22H30N2O3S (C22 H30 N2 O3 S)

Compound Name

N-cyclohexyl-2-{N-[(furan-2-yl)methyl]-2-(thiophen-2-yl)acetamido}-2-methylbutanamide

IUPAC name

N-cyclohexyl-2-{N-[(furan-2-yl)methyl]-2-(thiophen-2-yl)acetamido}-2-methylbutanamide

SMILES

CCC(C)(C(NC1CCCCC1)=O)N(Cc1ccco1)C(Cc1cccs1)=O

InChI

InChI=1S/C22H30N2O3S/c1-3-22(2,21(26)23-17-9-5-4-6-10-17)24(16-18-11-7-13-27-18)20(25)15-19-12-8-14-28-19/h7-8,11-14,17H,3-6,9-10,15-16H2,1-2H3,(H,23,26)/t22-/m0/s1

InChI Key

MKLKKCFIJALGBZ-QFIPXVFZSA-N

MDL Number (MFCD)

MFCD03450020

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

402.56

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.683

Distribution Coefficient, logD

4.683

Water Solubility, LogSw

-4.24

Polar Surface Area

48.139

Acid Dissociation Constant (pKa)

14.81

Base Dissociation Constant (pKb)

2.71

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

54.50

C094-1736 in Drug Discovery

Included in Screening Libraries

Human Transcription Factors Annotated Library (5098 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 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 C094-1736 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C094-1736?
Check Price and Availability of C094-1736, 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 C094-1736 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C094-1736
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C094-1736
  • 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 C094-1736 available by request