K784-8955 Screening compound: N-[(2-chlorophenyl)methyl]-2-({5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)propanamide

K784-8955 Screening compound: N-[(2-chlorophenyl)methyl]-2-({5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)propanamide
K784-8955 Screening compound: N-[(2-chlorophenyl)methyl]-2-({5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K784-8955
N-[(2-chlorophenyl)methyl]-2-({5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)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

K784-8955

Molecular Formula

C17H18ClN5OS (C17 H18 ClN5 OS)

Compound Name

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

IUPAC name

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

SMILES

CC(C(NCc(cccc1)c1Cl)=O)Sc1nn2c(C)cc(C)nc2n1

InChI

InChI=1S/C17H18ClN5OS/c1-10-8-11(2)23-16(20-10)21-17(22-23)25-12(3)15(24)19-9-13-6-4-5-7-14(13)18/h4-8,12H,9H2,1-3H3,(H,19,24)/t12-/m0/s1

InChI Key

HHHRGKREYXWRIG-LBPRGKRZSA-N

MDL Number (MFCD)

MFCD15099293

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

375.88

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

2.763

Distribution Coefficient, logD

2.762

Water Solubility, LogSw

-3.42

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

29.40

K784-8955 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

Antiviral Library (67538 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with K784-8955 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K784-8955?
Check Price and Availability of K784-8955, 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 K784-8955 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K784-8955
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K784-8955
  • 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 K784-8955 available by request