K297-0125 Screening compound: 7-CHLORO-2-[({4-[(4-CHLOROBENZYL)AMINO]-2-QUINAZOLINYL}SULFANYL)METHYL]-4H-PYRIDO[1,2-A]PYRIMIDIN-4-ONE

K297-0125 Screening compound: 7-CHLORO-2-[({4-[(4-CHLOROBENZYL)AMINO]-2-QUINAZOLINYL}SULFANYL)METHYL]-4H-PYRIDO[1,2-A]PYRIMIDIN-4-ONE
K297-0125 Screening compound: 7-CHLORO-2-[({4-[(4-CHLOROBENZYL)AMINO]-2-QUINAZOLINYL}SULFANYL)METHYL]-4H-PYRIDO[1,2-A]PYRIMIDIN-4-ONE alternative view

Chemical Structure Depiction of ChemDiv screening compound K297-0125
7-CHLORO-2-[({4-[(4-CHLOROBENZYL)AMINO]-2-QUINAZOLINYL}SULFANYL)METHYL]-4H-PYRIDO[1,2-A]PYRIMIDIN-4-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

K297-0125

Molecular Formula

C24H17Cl2N5OS (C24 H17 Cl2 N5 OS)

Compound Name

7-CHLORO-2-[({4-[(4-CHLOROBENZYL)AMINO]-2-QUINAZOLINYL}SULFANYL)METHYL]-4H-PYRIDO[1,2-A]PYRIMIDIN-4-ONE

IUPAC name

n/a

SMILES

O=C1N(C=C(C=C2)Cl)C2=NC(CSc2nc3ccccc3c(NCc(cc3)ccc3Cl)n2)=C1

InChI

InChI=1S/C24H17Cl2N5OS/c25-16-7-5-15(6-8-16)12-27-23-19-3-1-2-4-20(19)29-24(30-23)33-14-18-11-22(32)31-13-17(26)9-10-21(31)28-18/h1-11,13H,12,14H2,(H,27,29,30)

InChI Key

HZZFSHZSJKYDSK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05030244

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

494.4

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

4.885

Distribution Coefficient, logD

4.885

Water Solubility, LogSw

-5.10

Polar Surface Area

54.355

Acid Dissociation Constant (pKa)

16.06

Base Dissociation Constant (pKb)

3.38

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.30

K297-0125 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

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

Targeted Diversity Library (40567 compounds)

Anti-HIV1 Library (19540 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with K297-0125 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K297-0125?
Check Price and Availability of K297-0125, 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 K297-0125 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K297-0125
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K297-0125
  • 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 K297-0125 available by request