F319-1647 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(5-cyclopentyl-1,2,4-oxadiazol-3-yl)benzamide

F319-1647 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(5-cyclopentyl-1,2,4-oxadiazol-3-yl)benzamide
F319-1647 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(5-cyclopentyl-1,2,4-oxadiazol-3-yl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F319-1647
N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(5-cyclopentyl-1,2,4-oxadiazol-3-yl)benzamide

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

F319-1647

Molecular Formula

C22H21N3O4 (C22 H21 N3 O4)

Compound Name

N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(5-cyclopentyl-1,2,4-oxadiazol-3-yl)benzamide

IUPAC name

N-[(2H-13-benzodioxol-5-yl)methyl]-4-(5-cyclopentyl-124-oxadiazol-3-yl)benzamide

SMILES

O=C(c(cc1)ccc1-c1noc(C2CCCC2)n1)NCc(cc1)cc2c1OCO2

InChI

InChI=1S/C22H21N3O4/c26-21(23-12-14-5-10-18-19(11-14)28-13-27-18)16-8-6-15(7-9-16)20-24-22(29-25-20)17-3-1-2-4-17/h5-11,17H,1-4,12-13H2,(H,23,26)

InChI Key

FAQYQBZSCVVCHQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27115233

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

391.43

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.838

Distribution Coefficient, logD

4.838

Water Solubility, LogSw

-4.92

Polar Surface Area

73.731

Acid Dissociation Constant (pKa)

13.29

Base Dissociation Constant (pKb)

-3.10

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.80

F319-1647 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with F319-1647 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F319-1647?
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What is the minimum amount of F319-1647 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F319-1647
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F319-1647
  • 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 F319-1647 available by request