K280-0578 Screening compound: N-(4-chloro-2-fluorophenyl)-2-({2-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-[1,2,4]triazolo[1,5-c]quinazolin-5-yl}sulfanyl)acetamide

K280-0578 Screening compound: N-(4-chloro-2-fluorophenyl)-2-({2-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-[1,2,4]triazolo[1,5-c]quinazolin-5-yl}sulfanyl)acetamide
K280-0578 Screening compound: N-(4-chloro-2-fluorophenyl)-2-({2-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-[1,2,4]triazolo[1,5-c]quinazolin-5-yl}sulfanyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K280-0578
N-(4-chloro-2-fluorophenyl)-2-({2-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-[1,2,4]triazolo[1,5-c]quinazolin-5-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

K280-0578

Molecular Formula

C24H21ClFN7OS (C24 H21 ClFN7 OS)

Compound Name

N-(4-chloro-2-fluorophenyl)-2-({2-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-[1,2,4]triazolo[1,5-c]quinazolin-5-yl}sulfanyl)acetamide

IUPAC name

N-(4-chloro-2-fluorophenyl)-2-({2-[2-(35-dimethyl-1H-pyrazol-4-yl)ethyl]-[124]triazolo[15-c]quinazolin-5-yl}sulfanyl)acetamide

SMILES

Cc1c(CCc2nn3c(SCC(Nc(ccc(Cl)c4)c4F)=O)nc(cccc4)c4c3n2)c(C)n[nH]1

InChI

InChI=1S/C24H21ClFN7OS/c1-13-16(14(2)31-30-13)8-10-21-29-23-17-5-3-4-6-19(17)28-24(33(23)32-21)35-12-22(34)27-20-9-7-15(25)11-18(20)26/h3-7,9,11H,8,10,12H2,1-2H3,(H,27,34)(H,30,31)

InChI Key

DBOQBNRJYLMIGS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15087565

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

509.99

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.881

Distribution Coefficient, logD

4.308

Water Solubility, LogSw

-4.86

Polar Surface Area

77.154

Acid Dissociation Constant (pKa)

9.14

Base Dissociation Constant (pKb)

7.84

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.80

K280-0578 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Agro:
  • Agro
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with K280-0578 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K280-0578?
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What is the minimum amount of K280-0578 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K280-0578
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K280-0578
  • 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 K280-0578 available by request