F971-0689 Screening compound: 4-[2-(1H-1,3-benzodiazol-2-yl)ethyl]-N-[(3-bromophenyl)methyl]benzamide

F971-0689 Screening compound: 4-[2-(1H-1,3-benzodiazol-2-yl)ethyl]-N-[(3-bromophenyl)methyl]benzamide
F971-0689 Screening compound: 4-[2-(1H-1,3-benzodiazol-2-yl)ethyl]-N-[(3-bromophenyl)methyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F971-0689
4-[2-(1H-1,3-benzodiazol-2-yl)ethyl]-N-[(3-bromophenyl)methyl]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

F971-0689

Molecular Formula

C23H20BrN3O (C23 H20 BrN3 O)

Compound Name

4-[2-(1H-1,3-benzodiazol-2-yl)ethyl]-N-[(3-bromophenyl)methyl]benzamide

IUPAC name

4-[2-(1H-13-benzodiazol-2-yl)ethyl]-N-[(3-bromophenyl)methyl]benzamide

SMILES

O=C(c1ccc(CCc2nc(cccc3)c3[nH]2)cc1)NCc1cccc(Br)c1

InChI

InChI=1S/C23H20BrN3O/c24-19-5-3-4-17(14-19)15-25-23(28)18-11-8-16(9-12-18)10-13-22-26-20-6-1-2-7-21(20)27-22/h1-9,11-12,14H,10,13,15H2,(H,25,28)(H,26,27)

InChI Key

ZLHAKSZIZQEZHT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27206272

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

434.34

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.240

Distribution Coefficient, logD

5.214

Water Solubility, LogSw

-5.52

Polar Surface Area

44.662

Acid Dissociation Constant (pKa)

11.60

Base Dissociation Constant (pKb)

6.18

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.00

F971-0689 in Drug Discovery

Included in Screening Libraries

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

CNS Targets (44014 compounds)

PI3K-Targeted Library (17255 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
  • Nervous system
  • Cardiovascular
Targets:
  • Kinases
  • Proteases
  • Ion Channels

References: we are preparing a list of scientific research reports with F971-0689 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F971-0689?
Check Price and Availability of F971-0689, 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 F971-0689 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F971-0689
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F971-0689
  • 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 F971-0689 available by request