K784-8959 Screening compound: 2-({5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)-N-[(4-methylphenyl)methyl]propanamide

K784-8959 Screening compound: 2-({5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)-N-[(4-methylphenyl)methyl]propanamide
K784-8959 Screening compound: 2-({5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)-N-[(4-methylphenyl)methyl]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K784-8959
2-({5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)-N-[(4-methylphenyl)methyl]propanamide

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

K784-8959

Molecular Formula

C18H21N5OS (C18 H21 N5 OS)

Compound Name

2-({5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)-N-[(4-methylphenyl)methyl]propanamide

IUPAC name

2-({57-dimethyl-[124]triazolo[15-a]pyrimidin-2-yl}sulfanyl)-N-[(4-methylphenyl)methyl]propanamide

SMILES

CC(C(NCc1ccc(C)cc1)=O)Sc1nn2c(C)cc(C)nc2n1

InChI

InChI=1S/C18H21N5OS/c1-11-5-7-15(8-6-11)10-19-16(24)14(4)25-18-21-17-20-12(2)9-13(3)23(17)22-18/h5-9,14H,10H2,1-4H3,(H,19,24)/t14-/m0/s1

InChI Key

SIUBNUKVWGDRPS-AWEZNQCLSA-N

MDL Number (MFCD)

MFCD15099295

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

355.46

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.404

Distribution Coefficient, logD

2.404

Water Solubility, LogSw

-2.78

Polar Surface Area

53.965

Acid Dissociation Constant (pKa)

13.03

Base Dissociation Constant (pKb)

3.56

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

33.30

K784-8959 in Drug Discovery

Included in Screening Libraries

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 K784-8959 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K784-8959?
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What is the minimum amount of K784-8959 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K784-8959
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K784-8959
  • 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 K784-8959 available by request