D655-0189 Screening compound: 2-bromo-N-{4-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]phenyl}benzamide

D655-0189 Screening compound: 2-bromo-N-{4-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]phenyl}benzamide
D655-0189 Screening compound: 2-bromo-N-{4-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]phenyl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D655-0189
2-bromo-N-{4-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]phenyl}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

D655-0189

Molecular Formula

C22H16BrN3O3 (C22 H16 BrN3 O3)

Compound Name

2-bromo-N-{4-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]phenyl}benzamide

IUPAC name

2-bromo-N-{4-[3-(4-methoxyphenyl)-124-oxadiazol-5-yl]phenyl}benzamide

SMILES

COc(cc1)ccc1-c1noc(-c(cc2)ccc2NC(c(cccc2)c2Br)=O)n1

InChI

InChI=1S/C22H16BrN3O3/c1-28-17-12-8-14(9-13-17)20-25-22(29-26-20)15-6-10-16(11-7-15)24-21(27)18-4-2-3-5-19(18)23/h2-13H,1H3,(H,24,27)

InChI Key

GGSJCXHBIGLMGM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD18079355

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

450.29

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.335

Distribution Coefficient, logD

5.334

Water Solubility, LogSw

-5.33

Polar Surface Area

62.279

Acid Dissociation Constant (pKa)

10.70

Base Dissociation Constant (pKb)

-2.92

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.50

D655-0189 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with D655-0189 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D655-0189?
Check Price and Availability of D655-0189, 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 D655-0189 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D655-0189
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D655-0189
  • 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 D655-0189 available by request