K784-8717 Screening compound: 2-({6-[(2-chlorophenyl)methyl]-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)-N-[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]acetamide

K784-8717 Screening compound: 2-({6-[(2-chlorophenyl)methyl]-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)-N-[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]acetamide
K784-8717 Screening compound: 2-({6-[(2-chlorophenyl)methyl]-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)-N-[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K784-8717
2-({6-[(2-chlorophenyl)methyl]-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)-N-[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]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

K784-8717

Molecular Formula

C25H24ClN5O3S (C25 H24 ClN5 O3 S)

Compound Name

2-({6-[(2-chlorophenyl)methyl]-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)-N-[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]acetamide

IUPAC name

2-({6-[(2-chlorophenyl)methyl]-57-dimethyl-[124]triazolo[15-a]pyrimidin-2-yl}sulfanyl)-N-[(23-dihydro-14-benzodioxin-2-yl)methyl]acetamide

SMILES

Cc1c(Cc(cccc2)c2Cl)c(C)nc2nc(SCC(NCC3Oc(cccc4)c4OC3)=O)nn12

InChI

InChI=1S/C25H24ClN5O3S/c1-15-19(11-17-7-3-4-8-20(17)26)16(2)31-24(28-15)29-25(30-31)35-14-23(32)27-12-18-13-33-21-9-5-6-10-22(21)34-18/h3-10,18H,11-14H2,1-2H3,(H,27,32)/t18-/m0/s1

InChI Key

FXANJZOHCLMKSS-SFHVURJKSA-N

MDL Number (MFCD)

MFCD15099248

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

510.02

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.185

Distribution Coefficient, logD

4.185

Water Solubility, LogSw

-4.35

Polar Surface Area

69.706

Acid Dissociation Constant (pKa)

14.82

Base Dissociation Constant (pKb)

3.58

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

28.00

K784-8717 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Antiviral Library (67538 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with K784-8717 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K784-8717?
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What is the minimum amount of K784-8717 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K784-8717
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K784-8717
  • 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 K784-8717 available by request