F313-0009 Screening compound: 2-[2-(4-cyanoanilino)-2-oxoethoxy]-N~1~-[4-(2-cyclohexylethoxy)phenyl]acetamide

F313-0009 Screening compound: 2-[2-(4-cyanoanilino)-2-oxoethoxy]-N~1~-[4-(2-cyclohexylethoxy)phenyl]acetamide
F313-0009 Screening compound: 2-[2-(4-cyanoanilino)-2-oxoethoxy]-N~1~-[4-(2-cyclohexylethoxy)phenyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F313-0009
2-[2-(4-cyanoanilino)-2-oxoethoxy]-N~1~-[4-(2-cyclohexylethoxy)phenyl]acetamide

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

F313-0009

Molecular Formula

C25H29N3O4 (C25 H29 N3 O4)

Compound Name

2-[2-(4-cyanoanilino)-2-oxoethoxy]-N~1~-[4-(2-cyclohexylethoxy)phenyl]acetamide

IUPAC name

n/a

SMILES

N#Cc(cc1)ccc1NC(COCC(Nc(cc1)ccc1OCCC1CCCCC1)=O)=O

InChI

InChI=1S/C25H29N3O4/c26-16-20-6-8-21(9-7-20)27-24(29)17-31-18-25(30)28-22-10-12-23(13-11-22)32-15-14-19-4-2-1-3-5-19/h6-13,19H,1-5,14-15,17-18H2,(H,27,29)(H,28,30)

InChI Key

NPKAIFMQRHIRMA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08678624

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

435.52

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.640

Distribution Coefficient, logD

4.639

Water Solubility, LogSw

-4.62

Polar Surface Area

79.094

Acid Dissociation Constant (pKa)

10.54

Base Dissociation Constant (pKb)

1.48

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

F313-0009 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 F313-0009 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F313-0009?
Check Price and Availability of F313-0009, 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 F313-0009 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F313-0009
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F313-0009
  • 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 F313-0009 available by request