8019-4913 Screening compound: N-(2-{[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]formamido}ethyl)-2-fluorobenzamide

8019-4913 Screening compound: N-(2-{[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]formamido}ethyl)-2-fluorobenzamide
8019-4913 Screening compound: N-(2-{[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]formamido}ethyl)-2-fluorobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8019-4913
N-(2-{[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]formamido}ethyl)-2-fluorobenzamide

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

8019-4913

Molecular Formula

C19H15FN4O5 (C19 H15 FN4 O5)

Compound Name

N-(2-{[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]formamido}ethyl)-2-fluorobenzamide

IUPAC name

N-(2-{[3-(2H-13-benzodioxol-5-yl)-124-oxadiazol-5-yl]formamido}ethyl)-2-fluorobenzamide

SMILES

O=C(c1nc(-c(cc2)cc3c2OCO3)no1)NCCNC(c(cccc1)c1F)=O

InChI

InChI=1S/C19H15FN4O5/c20-13-4-2-1-3-12(13)17(25)21-7-8-22-18(26)19-23-16(24-29-19)11-5-6-14-15(9-11)28-10-27-14/h1-6,9H,7-8,10H2,(H,21,25)(H,22,26)

InChI Key

NHDIZVISWMSHAZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08093371

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

398.35

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.355

Distribution Coefficient, logD

2.355

Water Solubility, LogSw

-3.16

Polar Surface Area

97.812

Acid Dissociation Constant (pKa)

12.87

Base Dissociation Constant (pKb)

-2.74

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.80

8019-4913 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 8019-4913 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8019-4913?
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What is the minimum amount of 8019-4913 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8019-4913
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8019-4913
  • 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 8019-4913 available by request