K297-1040 Screening compound: N-[2-(4-sulfamoylphenyl)ethyl]-6-[(2-sulfanylidene-1,2-dihydroquinazolin-4-yl)amino]hexanamide

K297-1040 Screening compound: N-[2-(4-sulfamoylphenyl)ethyl]-6-[(2-sulfanylidene-1,2-dihydroquinazolin-4-yl)amino]hexanamide
K297-1040 Screening compound: N-[2-(4-sulfamoylphenyl)ethyl]-6-[(2-sulfanylidene-1,2-dihydroquinazolin-4-yl)amino]hexanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K297-1040
N-[2-(4-sulfamoylphenyl)ethyl]-6-[(2-sulfanylidene-1,2-dihydroquinazolin-4-yl)amino]hexanamide

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

K297-1040

Molecular Formula

C22H27N5O3S2 (C22 H27 N5 O3 S2)

Compound Name

N-[2-(4-sulfamoylphenyl)ethyl]-6-[(2-sulfanylidene-1,2-dihydroquinazolin-4-yl)amino]hexanamide

IUPAC name

N-[2-(4-sulfamoylphenyl)ethyl]-6-[(2-sulfanylidene-12-dihydroquinazolin-4-yl)amino]hexanamide

SMILES

NS(c1ccc(CCNC(CCCCCNC(c(cccc2)c2N2)=NC2=S)=O)cc1)(=O)=O

InChI

InChI=1S/C22H27N5O3S2/c23-32(29,30)17-11-9-16(10-12-17)13-15-24-20(28)8-2-1-5-14-25-21-18-6-3-4-7-19(18)26-22(31)27-21/h3-4,6-7,9-12H,1-2,5,8,13-15H2,(H,24,28)(H2,23,29,30)(H2,25,26,27,31)

InChI Key

GYDMMQIUEONGSS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15092597

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

473.62

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

5.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

0.985

Distribution Coefficient, logD

-0.113

Water Solubility, LogSw

-2.22

Polar Surface Area

105.820

Acid Dissociation Constant (pKa)

10.17

Base Dissociation Constant (pKb)

8.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.80

K297-1040 in Drug Discovery

Included in Screening Libraries

CORONAVIRUS Library (20774 compounds)

Eccentric PPI Library (11937 compounds)

PLpro Library (6343 compounds)

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with K297-1040 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K297-1040?
Check Price and Availability of K297-1040, 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 K297-1040 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K297-1040
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K297-1040
  • 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 K297-1040 available by request