F313-0589 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-{[(4-methylphenyl)carbamoyl]methoxy}acetamide

F313-0589 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-{[(4-methylphenyl)carbamoyl]methoxy}acetamide
F313-0589 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-{[(4-methylphenyl)carbamoyl]methoxy}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F313-0589
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-{[(4-methylphenyl)carbamoyl]methoxy}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

F313-0589

Molecular Formula

C19H20N2O5 (C19 H20 N2 O5)

Compound Name

N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-{[(4-methylphenyl)carbamoyl]methoxy}acetamide

IUPAC name

N-[(2H-13-benzodioxol-5-yl)methyl]-2-{[(4-methylphenyl)carbamoyl]methoxy}acetamide

SMILES

Cc(cc1)ccc1NC(COCC(NCc(cc1)cc2c1OCO2)=O)=O

InChI

InChI=1S/C19H20N2O5/c1-13-2-5-15(6-3-13)21-19(23)11-24-10-18(22)20-9-14-4-7-16-17(8-14)26-12-25-16/h2-8H,9-12H2,1H3,(H,20,22)(H,21,23)

InChI Key

VMQXJFDURWAVPF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08678805

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

356.38

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.254

Distribution Coefficient, logD

2.254

Water Solubility, LogSw

-2.90

Polar Surface Area

73.137

Acid Dissociation Constant (pKa)

12.65

Base Dissociation Constant (pKb)

1.44

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.30

F313-0589 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 F313-0589 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F313-0589?
Check Price and Availability of F313-0589, 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 F313-0589 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F313-0589
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F313-0589
  • 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 F313-0589 available by request