F780-6454 Screening compound: N-{2-[2-(1H-1,3-benzodiazol-2-yl)ethyl]phenyl}-2-(4-chlorophenoxy)acetamide

F780-6454 Screening compound: N-{2-[2-(1H-1,3-benzodiazol-2-yl)ethyl]phenyl}-2-(4-chlorophenoxy)acetamide
F780-6454 Screening compound: N-{2-[2-(1H-1,3-benzodiazol-2-yl)ethyl]phenyl}-2-(4-chlorophenoxy)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F780-6454
N-{2-[2-(1H-1,3-benzodiazol-2-yl)ethyl]phenyl}-2-(4-chlorophenoxy)acetamide

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

F780-6454

Molecular Formula

C23H20ClN3O2 (C23 H20 ClN3 O2)

Compound Name

N-{2-[2-(1H-1,3-benzodiazol-2-yl)ethyl]phenyl}-2-(4-chlorophenoxy)acetamide

IUPAC name

N-{2-[2-(1H-13-benzodiazol-2-yl)ethyl]phenyl}-2-(4-chlorophenoxy)acetamide

SMILES

O=C(COc(cc1)ccc1Cl)Nc1c(CCc2nc(cccc3)c3[nH]2)cccc1

InChI

InChI=1S/C23H20ClN3O2/c24-17-10-12-18(13-11-17)29-15-23(28)27-19-6-2-1-5-16(19)9-14-22-25-20-7-3-4-8-21(20)26-22/h1-8,10-13H,9,14-15H2,(H,25,26)(H,27,28)

InChI Key

VSUHPQVMUNNBPX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14966347

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

405.88

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.299

Distribution Coefficient, logD

5.239

Water Solubility, LogSw

-5.91

Polar Surface Area

49.928

Acid Dissociation Constant (pKa)

11.93

Base Dissociation Constant (pKb)

6.57

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.00

F780-6454 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with F780-6454 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F780-6454?
Check Price and Availability of F780-6454, 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 F780-6454 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F780-6454
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F780-6454
  • 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 F780-6454 available by request