F465-0918 Screening compound: ethyl 3-(2-{[5-(3-bromophenyl)-1,3-oxazol-2-yl]sulfanyl}acetamido)benzoate

F465-0918 Screening compound: ethyl 3-(2-{[5-(3-bromophenyl)-1,3-oxazol-2-yl]sulfanyl}acetamido)benzoate
F465-0918 Screening compound: ethyl 3-(2-{[5-(3-bromophenyl)-1,3-oxazol-2-yl]sulfanyl}acetamido)benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound F465-0918
ethyl 3-(2-{[5-(3-bromophenyl)-1,3-oxazol-2-yl]sulfanyl}acetamido)benzoate

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

F465-0918

Molecular Formula

C20H17BrN2O4S (C20 H17 BrN2 O4 S)

Compound Name

ethyl 3-(2-{[5-(3-bromophenyl)-1,3-oxazol-2-yl]sulfanyl}acetamido)benzoate

IUPAC name

ethyl 3-(2-{[5-(3-bromophenyl)-13-oxazol-2-yl]sulfanyl}acetamido)benzoate

SMILES

CCOC(c1cccc(NC(CSc2ncc(-c3cccc(Br)c3)o2)=O)c1)=O

InChI

InChI=1S/C20H17BrN2O4S/c1-2-26-19(25)14-6-4-8-16(10-14)23-18(24)12-28-20-22-11-17(27-20)13-5-3-7-15(21)9-13/h3-11H,2,12H2,1H3,(H,23,24)

InChI Key

HGVMCHXBKVLVRE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27131448

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

461.34

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.514

Distribution Coefficient, logD

5.514

Water Solubility, LogSw

-5.25

Polar Surface Area

61.175

Acid Dissociation Constant (pKa)

12.25

Base Dissociation Constant (pKb)

-0.40

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.00

F465-0918 in Drug Discovery

Included in Screening Libraries

SH2 Library (10483 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Endocrine
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with F465-0918 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F465-0918?
Check Price and Availability of F465-0918, 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 F465-0918 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F465-0918
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F465-0918
  • 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 F465-0918 available by request