K292-1228 Screening compound: 6-{2-[({[2-(3,4-dimethoxyphenyl)ethyl]carbamoyl}methyl)sulfanyl]-4-oxo-3H,4H-thieno[3,2-d]pyrimidin-3-yl}-N-(4-methoxyphenyl)hexanamide

K292-1228 Screening compound: 6-{2-[({[2-(3,4-dimethoxyphenyl)ethyl]carbamoyl}methyl)sulfanyl]-4-oxo-3H,4H-thieno[3,2-d]pyrimidin-3-yl}-N-(4-methoxyphenyl)hexanamide
K292-1228 Screening compound: 6-{2-[({[2-(3,4-dimethoxyphenyl)ethyl]carbamoyl}methyl)sulfanyl]-4-oxo-3H,4H-thieno[3,2-d]pyrimidin-3-yl}-N-(4-methoxyphenyl)hexanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K292-1228
6-{2-[({[2-(3,4-dimethoxyphenyl)ethyl]carbamoyl}methyl)sulfanyl]-4-oxo-3H,4H-thieno[3,2-d]pyrimidin-3-yl}-N-(4-methoxyphenyl)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

K292-1228

Molecular Formula

C31H36N4O6S2 (C31 H36 N4 O6 S2)

Compound Name

6-{2-[({[2-(3,4-dimethoxyphenyl)ethyl]carbamoyl}methyl)sulfanyl]-4-oxo-3H,4H-thieno[3,2-d]pyrimidin-3-yl}-N-(4-methoxyphenyl)hexanamide

IUPAC name

6-{2-[({[2-(34-dimethoxyphenyl)ethyl]carbamoyl}methyl)sulfanyl]-4-oxo-3H4H-thieno[32-d]pyrimidin-3-yl}-N-(4-methoxyphenyl)hexanamide

SMILES

COc(cc1)ccc1NC(CCCCCN(C1=O)C(SCC(NCCc(cc2)cc(OC)c2OC)=O)=Nc2c1scc2)=O

InChI

InChI=1S/C31H36N4O6S2/c1-39-23-11-9-22(10-12-23)33-27(36)7-5-4-6-17-35-30(38)29-24(15-18-42-29)34-31(35)43-20-28(37)32-16-14-21-8-13-25(40-2)26(19-21)41-3/h8-13,15,18-19H,4-7,14,16-17,20H2,1-3H3,(H,32,37)(H,33,36)

InChI Key

ACUDXTNBKVQORN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15091722

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

624.78

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

18.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

3.541

Distribution Coefficient, logD

3.541

Water Solubility, LogSw

-3.85

Polar Surface Area

97.035

Acid Dissociation Constant (pKa)

12.20

Base Dissociation Constant (pKb)

1.30

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.50

K292-1228 in Drug Discovery

Included in Screening Libraries

3CLpro Library (4801 compounds)

CORONAVIRUS Library (20774 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 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 K292-1228 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K292-1228?
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What is the minimum amount of K292-1228 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K292-1228
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K292-1228
  • 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 K292-1228 available by request