K284-4510 Screening compound: 4-[(2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-4-oxo-3,4-dihydroquinazolin-3-yl)methyl]-N-[(2-chlorophenyl)methyl]cyclohexane-1-carboxamide

K284-4510 Screening compound: 4-[(2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-4-oxo-3,4-dihydroquinazolin-3-yl)methyl]-N-[(2-chlorophenyl)methyl]cyclohexane-1-carboxamide
K284-4510 Screening compound: 4-[(2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-4-oxo-3,4-dihydroquinazolin-3-yl)methyl]-N-[(2-chlorophenyl)methyl]cyclohexane-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K284-4510
4-[(2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-4-oxo-3,4-dihydroquinazolin-3-yl)methyl]-N-[(2-chlorophenyl)methyl]cyclohexane-1-carboxamide

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

K284-4510

Molecular Formula

C31H29Cl2N3O3S (C31 H29 Cl2 N3 O3 S)

Compound Name

4-[(2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-4-oxo-3,4-dihydroquinazolin-3-yl)methyl]-N-[(2-chlorophenyl)methyl]cyclohexane-1-carboxamide

IUPAC name

4-[(2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-4-oxo-34-dihydroquinazolin-3-yl)methyl]-N-[(2-chlorophenyl)methyl]cyclohexane-1-carboxamide

SMILES

O=C(CSC(N1CC(CC2)CCC2C(NCc(cccc2)c2Cl)=O)=Nc(cccc2)c2C1=O)c(cc1)ccc1Cl

InChI

InChI=1S/C31H29Cl2N3O3S/c32-24-15-13-21(14-16-24)28(37)19-40-31-35-27-8-4-2-6-25(27)30(39)36(31)18-20-9-11-22(12-10-20)29(38)34-17-23-5-1-3-7-26(23)33/h1-8,13-16,20,22H,9-12,17-19H2,(H,34,38)

InChI Key

IQRSNQBTXKANMC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15088310

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

594.56

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.425

Distribution Coefficient, logD

6.425

Water Solubility, LogSw

-6.07

Polar Surface Area

63.623

Acid Dissociation Constant (pKa)

12.56

Base Dissociation Constant (pKb)

0.57

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.00

K284-4510 in Drug Discovery

Included in Screening Libraries

3CLpro Library (4801 compounds)

CORONAVIRUS Library (20774 compounds)

PLpro Library (6343 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with K284-4510 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K284-4510?
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What is the minimum amount of K284-4510 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K284-4510
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K284-4510
  • 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 K284-4510 available by request