K297-1035 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-6-[(2-sulfanylidene-1,2-dihydroquinazolin-4-yl)amino]hexanamide

K297-1035 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-6-[(2-sulfanylidene-1,2-dihydroquinazolin-4-yl)amino]hexanamide
K297-1035 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-6-[(2-sulfanylidene-1,2-dihydroquinazolin-4-yl)amino]hexanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K297-1035
N-[(2H-1,3-benzodioxol-5-yl)methyl]-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

K297-1035

Molecular Formula

C22H24N4O3S (C22 H24 N4 O3 S)

Compound Name

N-[(2H-1,3-benzodioxol-5-yl)methyl]-6-[(2-sulfanylidene-1,2-dihydroquinazolin-4-yl)amino]hexanamide

IUPAC name

N-[(2H-13-benzodioxol-5-yl)methyl]-6-[(2-sulfanylidene-12-dihydroquinazolin-4-yl)amino]hexanamide

SMILES

O=C(CCCCCNC(c(cccc1)c1N1)=NC1=S)NCc(cc1)cc2c1OCO2

InChI

InChI=1S/C22H24N4O3S/c27-20(24-13-15-9-10-18-19(12-15)29-14-28-18)8-2-1-5-11-23-21-16-6-3-4-7-17(16)25-22(30)26-21/h3-4,6-7,9-10,12H,1-2,5,8,11,13-14H2,(H,24,27)(H2,23,25,26,30)

InChI Key

WOSULWHBGWOKOO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15092592

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

424.52

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.763

Distribution Coefficient, logD

1.665

Water Solubility, LogSw

-3.46

Polar Surface Area

72.490

Acid Dissociation Constant (pKa)

10.17

Base Dissociation Constant (pKb)

8.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.80

K297-1035 in Drug Discovery

Included in Screening Libraries

CORONAVIRUS Library (20774 compounds)

PLpro Library (6343 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with K297-1035 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K297-1035?
Check Price and Availability of K297-1035, 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 K297-1035 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K297-1035
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K297-1035
  • 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 K297-1035 available by request