K784-1213 Screening compound: N-[2-(4-chlorophenyl)ethyl]-1-(3,5-dimethylphenyl)-2-methyl-1H-1,3-benzodiazole-5-carboxamide

K784-1213 Screening compound: N-[2-(4-chlorophenyl)ethyl]-1-(3,5-dimethylphenyl)-2-methyl-1H-1,3-benzodiazole-5-carboxamide
K784-1213 Screening compound: N-[2-(4-chlorophenyl)ethyl]-1-(3,5-dimethylphenyl)-2-methyl-1H-1,3-benzodiazole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K784-1213
N-[2-(4-chlorophenyl)ethyl]-1-(3,5-dimethylphenyl)-2-methyl-1H-1,3-benzodiazole-5-carboxamide

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

K784-1213

Molecular Formula

C25H24ClN3O (C25 H24 ClN3 O)

Compound Name

N-[2-(4-chlorophenyl)ethyl]-1-(3,5-dimethylphenyl)-2-methyl-1H-1,3-benzodiazole-5-carboxamide

IUPAC name

N-[2-(4-chlorophenyl)ethyl]-1-(35-dimethylphenyl)-2-methyl-1H-13-benzodiazole-5-carboxamide

SMILES

Cc1nc(cc(cc2)C(NCCc(cc3)ccc3Cl)=O)c2n1-c1cc(C)cc(C)c1

InChI

InChI=1S/C25H24ClN3O/c1-16-12-17(2)14-22(13-16)29-18(3)28-23-15-20(6-9-24(23)29)25(30)27-11-10-19-4-7-21(26)8-5-19/h4-9,12-15H,10-11H2,1-3H3,(H,27,30)

InChI Key

AQTFXQSLSMLPJG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15097058

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

417.94

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.290

Distribution Coefficient, logD

5.034

Water Solubility, LogSw

-5.93

Polar Surface Area

35.942

Acid Dissociation Constant (pKa)

13.12

Base Dissociation Constant (pKb)

7.30

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

K784-1213 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Epigenetics Focused Set (26518 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
Agro:
  • Agro
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with K784-1213 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K784-1213?
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What is the minimum amount of K784-1213 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K784-1213
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K784-1213
  • 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 K784-1213 available by request