F620-0006 Screening compound: 3-({5-[(2-bromophenyl)methyl]-1,2,4-oxadiazol-3-yl}methyl)-2,3-dihydro-1,3-benzoxazol-2-one

F620-0006 Screening compound: 3-({5-[(2-bromophenyl)methyl]-1,2,4-oxadiazol-3-yl}methyl)-2,3-dihydro-1,3-benzoxazol-2-one
F620-0006 Screening compound: 3-({5-[(2-bromophenyl)methyl]-1,2,4-oxadiazol-3-yl}methyl)-2,3-dihydro-1,3-benzoxazol-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound F620-0006
3-({5-[(2-bromophenyl)methyl]-1,2,4-oxadiazol-3-yl}methyl)-2,3-dihydro-1,3-benzoxazol-2-one

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

F620-0006

Molecular Formula

C17H12BrN3O3 (C17 H12 BrN3 O3)

Compound Name

3-({5-[(2-bromophenyl)methyl]-1,2,4-oxadiazol-3-yl}methyl)-2,3-dihydro-1,3-benzoxazol-2-one

IUPAC name

3-({5-[(2-bromophenyl)methyl]-124-oxadiazol-3-yl}methyl)-23-dihydro-13-benzoxazol-2-one

SMILES

O=C1Oc(cccc2)c2N1Cc1noc(Cc(cccc2)c2Br)n1

InChI

InChI=1S/C17H12BrN3O3/c18-12-6-2-1-5-11(12)9-16-19-15(20-24-16)10-21-13-7-3-4-8-14(13)23-17(21)22/h1-8H,9-10H2

InChI Key

KFHZUYDPNYNRJF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27179223

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

386.2

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.885

Distribution Coefficient, logD

3.885

Water Solubility, LogSw

-4.35

Polar Surface Area

55.401

Acid Dissociation Constant (pKa)

28.83

Base Dissociation Constant (pKb)

-5.05

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.80

F620-0006 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 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 F620-0006 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F620-0006?
Check Price and Availability of F620-0006, 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 F620-0006 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F620-0006
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F620-0006
  • 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 F620-0006 available by request