K784-7865 Screening compound: 2-{[5,6-bis(4-ethoxyphenyl)-1,2,4-triazin-3-yl]sulfanyl}-N-cyclohexylacetamide

K784-7865 Screening compound: 2-{[5,6-bis(4-ethoxyphenyl)-1,2,4-triazin-3-yl]sulfanyl}-N-cyclohexylacetamide
K784-7865 Screening compound: 2-{[5,6-bis(4-ethoxyphenyl)-1,2,4-triazin-3-yl]sulfanyl}-N-cyclohexylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K784-7865
2-{[5,6-bis(4-ethoxyphenyl)-1,2,4-triazin-3-yl]sulfanyl}-N-cyclohexylacetamide

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

K784-7865

Molecular Formula

C27H32N4O3S (C27 H32 N4 O3 S)

Compound Name

2-{[5,6-bis(4-ethoxyphenyl)-1,2,4-triazin-3-yl]sulfanyl}-N-cyclohexylacetamide

IUPAC name

2-{[56-bis(4-ethoxyphenyl)-124-triazin-3-yl]sulfanyl}-N-cyclohexylacetamide

SMILES

CCOc(cc1)ccc1-c1nc(SCC(NC2CCCCC2)=O)nnc1-c(cc1)ccc1OCC

InChI

InChI=1S/C27H32N4O3S/c1-3-33-22-14-10-19(11-15-22)25-26(20-12-16-23(17-13-20)34-4-2)30-31-27(29-25)35-18-24(32)28-21-8-6-5-7-9-21/h10-17,21H,3-9,18H2,1-2H3,(H,28,32)

InChI Key

MHNGMQFNMYVKAJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15099034

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

492.64

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.267

Distribution Coefficient, logD

5.267

Water Solubility, LogSw

-4.96

Polar Surface Area

69.829

Acid Dissociation Constant (pKa)

15.76

Base Dissociation Constant (pKb)

4.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.70

K784-7865 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Human Proteases Annotated Library (2868 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with K784-7865 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K784-7865?
Check Price and Availability of K784-7865, 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 K784-7865 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K784-7865
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K784-7865
  • 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 K784-7865 available by request