K784-2284 Screening compound: N-[2-(cyclohex-1-en-1-yl)ethyl]-2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]acetamide

K784-2284 Screening compound: N-[2-(cyclohex-1-en-1-yl)ethyl]-2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]acetamide
K784-2284 Screening compound: N-[2-(cyclohex-1-en-1-yl)ethyl]-2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K784-2284
N-[2-(cyclohex-1-en-1-yl)ethyl]-2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]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

K784-2284

Molecular Formula

C25H26N4OS (C25 H26 N4 OS)

Compound Name

N-[2-(cyclohex-1-en-1-yl)ethyl]-2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]acetamide

IUPAC name

N-[2-(cyclohex-1-en-1-yl)ethyl]-2-[(56-diphenyl-124-triazin-3-yl)sulfanyl]acetamide

SMILES

O=C(CSc1nnc(-c2ccccc2)c(-c2ccccc2)n1)NCCC1=CCCCC1

InChI

InChI=1S/C25H26N4OS/c30-22(26-17-16-19-10-4-1-5-11-19)18-31-25-27-23(20-12-6-2-7-13-20)24(28-29-25)21-14-8-3-9-15-21/h2-3,6-10,12-15H,1,4-5,11,16-18H2,(H,26,30)

InChI Key

ICQDOFSGGOKKGM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05312187

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

430.57

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.249

Distribution Coefficient, logD

4.249

Water Solubility, LogSw

-4.19

Polar Surface Area

55.890

Acid Dissociation Constant (pKa)

15.33

Base Dissociation Constant (pKb)

0.84

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.00

K784-2284 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with K784-2284 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K784-2284?
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What is the minimum amount of K784-2284 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K784-2284
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K784-2284
  • 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 K784-2284 available by request