F545-1954 Screening compound: 3-[5-(2-bromophenyl)-1,2,4-oxadiazol-3-yl]-N-(propan-2-yl)benzamide

F545-1954 Screening compound: 3-[5-(2-bromophenyl)-1,2,4-oxadiazol-3-yl]-N-(propan-2-yl)benzamide
F545-1954 Screening compound: 3-[5-(2-bromophenyl)-1,2,4-oxadiazol-3-yl]-N-(propan-2-yl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F545-1954
3-[5-(2-bromophenyl)-1,2,4-oxadiazol-3-yl]-N-(propan-2-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

F545-1954

Molecular Formula

C18H16BrN3O2 (C18 H16 BrN3 O2)

Compound Name

3-[5-(2-bromophenyl)-1,2,4-oxadiazol-3-yl]-N-(propan-2-yl)benzamide

IUPAC name

3-[5-(2-bromophenyl)-124-oxadiazol-3-yl]-N-(propan-2-yl)benzamide

SMILES

CC(C)NC(c1cccc(-c2noc(-c(cccc3)c3Br)n2)c1)=O

InChI

InChI=1S/C18H16BrN3O2/c1-11(2)20-17(23)13-7-5-6-12(10-13)16-21-18(24-22-16)14-8-3-4-9-15(14)19/h3-11H,1-2H3,(H,20,23)

InChI Key

GTXLSWPQWLTUOG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27175488

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

386.25

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.140

Distribution Coefficient, logD

4.140

Water Solubility, LogSw

-4.41

Polar Surface Area

55.303

Acid Dissociation Constant (pKa)

14.35

Base Dissociation Constant (pKb)

-3.15

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

F545-1954 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with F545-1954 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F545-1954?
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What is the minimum amount of F545-1954 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F545-1954
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F545-1954
  • 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 F545-1954 available by request