K784-7389 Screening compound: 10-(4-methylbenzyl)-N~8~-(2-morpholinoethyl)-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide

K784-7389 Screening compound: 10-(4-methylbenzyl)-N~8~-(2-morpholinoethyl)-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
K784-7389 Screening compound: 10-(4-methylbenzyl)-N~8~-(2-morpholinoethyl)-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K784-7389
10-(4-methylbenzyl)-N~8~-(2-morpholinoethyl)-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-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

K784-7389

Molecular Formula

C28H29N3O3S (C28 H29 N3 O3 S)

Compound Name

10-(4-methylbenzyl)-N~8~-(2-morpholinoethyl)-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide

IUPAC name

9-[(4-methylphenyl)methyl]-N-[2-(morpholin-4-yl)ethyl]-10-oxo-2-thia-9-azatricyclo[9.4.0.0^{38}]pentadeca-1(15)3(8)461113-hexaene-6-carboxamide

SMILES

Cc1ccc(CN(c(cc(cc2)C(NCCN3CCOCC3)=O)c2Sc2c3cccc2)C3=O)cc1

InChI

InChI=1S/C28H29N3O3S/c1-20-6-8-21(9-7-20)19-31-24-18-22(27(32)29-12-13-30-14-16-34-17-15-30)10-11-26(24)35-25-5-3-2-4-23(25)28(31)33/h2-11,18H,12-17,19H2,1H3,(H,29,32)

InChI Key

AOAPLDDLTWXYIJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15098815

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

487.62

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.340

Distribution Coefficient, logD

4.326

Water Solubility, LogSw

-4.15

Polar Surface Area

51.546

Acid Dissociation Constant (pKa)

13.27

Base Dissociation Constant (pKb)

5.92

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.60

K784-7389 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

Antiviral Library (67538 compounds)

CNS targets activity set (6557 compounds)

Protein-Protein Interaction Library (218420 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 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 K784-7389 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K784-7389?
Check Price and Availability of K784-7389, 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 K784-7389 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K784-7389
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K784-7389
  • 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 K784-7389 available by request