K784-2344 Screening compound: 8-{[4-(2,3-dimethylphenyl)piperazino]carbonyl}dibenzo[b,f][1,4]thiazepin-11(10H)-one

K784-2344 Screening compound: 8-{[4-(2,3-dimethylphenyl)piperazino]carbonyl}dibenzo[b,f][1,4]thiazepin-11(10H)-one
K784-2344 Screening compound: 8-{[4-(2,3-dimethylphenyl)piperazino]carbonyl}dibenzo[b,f][1,4]thiazepin-11(10H)-one alternative view

Chemical Structure Depiction of ChemDiv screening compound K784-2344
8-{[4-(2,3-dimethylphenyl)piperazino]carbonyl}dibenzo[b,f][1,4]thiazepin-11(10H)-one

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

K784-2344

Molecular Formula

C26H25N3O2S (C26 H25 N3 O2 S)

Compound Name

8-{[4-(2,3-dimethylphenyl)piperazino]carbonyl}dibenzo[b,f][1,4]thiazepin-11(10H)-one

IUPAC name

6-[4-(23-dimethylphenyl)piperazine-1-carbonyl]-2-thia-9-azatricyclo[9.4.0.0^{38}]pentadeca-1(15)3(8)461113-hexaen-10-one

SMILES

Cc1cccc(N(CC2)CCN2C(c(cc2)cc(N3)c2Sc(cccc2)c2C3=O)=O)c1C

InChI

InChI=1S/C26H25N3O2S/c1-17-6-5-8-22(18(17)2)28-12-14-29(15-13-28)26(31)19-10-11-24-21(16-19)27-25(30)20-7-3-4-9-23(20)32-24/h3-11,16H,12-15H2,1-2H3,(H,27,30)

InChI Key

UYCXCKDAWINPAK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15097281

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

443.57

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.156

Distribution Coefficient, logD

5.156

Water Solubility, LogSw

-4.90

Polar Surface Area

44.783

Acid Dissociation Constant (pKa)

10.79

Base Dissociation Constant (pKb)

4.79

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.10

K784-2344 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Protein-Protein Interaction Library (218420 compounds)

Recognition Elements PPI Library (24135 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with K784-2344 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K784-2344?
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What is the minimum amount of K784-2344 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K784-2344
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K784-2344
  • 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 K784-2344 available by request