4334-0806 Screening compound: N-[4-(1H-1,3-benzodiazol-2-yl)phenyl]-2-(3-methylphenoxy)acetamide

4334-0806 Screening compound: N-[4-(1H-1,3-benzodiazol-2-yl)phenyl]-2-(3-methylphenoxy)acetamide
4334-0806 Screening compound: N-[4-(1H-1,3-benzodiazol-2-yl)phenyl]-2-(3-methylphenoxy)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 4334-0806
N-[4-(1H-1,3-benzodiazol-2-yl)phenyl]-2-(3-methylphenoxy)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

4334-0806

Molecular Formula

C22H19N3O2 (C22 H19 N3 O2)

Compound Name

N-[4-(1H-1,3-benzodiazol-2-yl)phenyl]-2-(3-methylphenoxy)acetamide

IUPAC name

N-[4-(1H-13-benzodiazol-2-yl)phenyl]-2-(3-methylphenoxy)acetamide

SMILES

Cc1cccc(OCC(Nc(cc2)ccc2-c2nc(cccc3)c3[nH]2)=O)c1

InChI

InChI=1S/C22H19N3O2/c1-15-5-4-6-18(13-15)27-14-21(26)23-17-11-9-16(10-12-17)22-24-19-7-2-3-8-20(19)25-22/h2-13H,14H2,1H3,(H,23,26)(H,24,25)

InChI Key

KSXGFONQUZTIFG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02032146

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

357.41

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.877

Distribution Coefficient, logD

4.875

Water Solubility, LogSw

-4.68

Polar Surface Area

49.635

Acid Dissociation Constant (pKa)

10.75

Base Dissociation Constant (pKb)

5.01

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.10

4334-0806 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Therapeutical Diversity Annotated Library (7563 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • 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 4334-0806 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4334-0806?
Check Price and Availability of 4334-0806, 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 4334-0806 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4334-0806
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4334-0806
  • 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 4334-0806 available by request