K280-0034 Screening compound: 1-(3,4-DICHLOROPHENYL)-2-({2-[2-(1H-INDOL-3-YL)ETHYL]-[1,2,4]TRIAZOLO[1,5-C]QUINAZOLIN-5-YL}SULFANYL)ETHAN-1-ONE

K280-0034 Screening compound: 1-(3,4-DICHLOROPHENYL)-2-({2-[2-(1H-INDOL-3-YL)ETHYL]-[1,2,4]TRIAZOLO[1,5-C]QUINAZOLIN-5-YL}SULFANYL)ETHAN-1-ONE
K280-0034 Screening compound: 1-(3,4-DICHLOROPHENYL)-2-({2-[2-(1H-INDOL-3-YL)ETHYL]-[1,2,4]TRIAZOLO[1,5-C]QUINAZOLIN-5-YL}SULFANYL)ETHAN-1-ONE alternative view

Chemical Structure Depiction of ChemDiv screening compound K280-0034
1-(3,4-DICHLOROPHENYL)-2-({2-[2-(1H-INDOL-3-YL)ETHYL]-[1,2,4]TRIAZOLO[1,5-C]QUINAZOLIN-5-YL}SULFANYL)ETHAN-1-ONE

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

K280-0034

Molecular Formula

C27H19Cl2N5OS (C27 H19 Cl2 N5 OS)

Compound Name

1-(3,4-DICHLOROPHENYL)-2-({2-[2-(1H-INDOL-3-YL)ETHYL]-[1,2,4]TRIAZOLO[1,5-C]QUINAZOLIN-5-YL}SULFANYL)ETHAN-1-ONE

IUPAC name

n/a

SMILES

O=C(CSc1nc(cccc2)c2c2nc(CCc3c[nH]c4c3cccc4)nn12)c(cc1)cc(Cl)c1Cl

InChI

InChI=1S/C27H19Cl2N5OS/c28-20-11-9-16(13-21(20)29)24(35)15-36-27-31-23-8-4-2-6-19(23)26-32-25(33-34(26)27)12-10-17-14-30-22-7-3-1-5-18(17)22/h1-9,11,13-14,30H,10,12,15H2

InChI Key

KBLAEJISMTXYCS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15087258

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

532.45

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

7.095

Distribution Coefficient, logD

7.081

Water Solubility, LogSw

-6.66

Polar Surface Area

53.905

Acid Dissociation Constant (pKa)

15.59

Base Dissociation Constant (pKb)

5.93

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

K280-0034 in Drug Discovery

Included in Screening Libraries

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

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with K280-0034 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K280-0034?
Check Price and Availability of K280-0034, 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 K280-0034 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K280-0034
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K280-0034
  • 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 K280-0034 available by request