C242-0423 Screening compound: 2-[3-(3-methoxyphenyl)-5,6-dimethyl-2,4-dioxo-1H,2H,3H,4H-thieno[2,3-d]pyrimidin-1-yl]-N-[2-(4-sulfamoylphenyl)ethyl]acetamide

C242-0423 Screening compound: 2-[3-(3-methoxyphenyl)-5,6-dimethyl-2,4-dioxo-1H,2H,3H,4H-thieno[2,3-d]pyrimidin-1-yl]-N-[2-(4-sulfamoylphenyl)ethyl]acetamide
C242-0423 Screening compound: 2-[3-(3-methoxyphenyl)-5,6-dimethyl-2,4-dioxo-1H,2H,3H,4H-thieno[2,3-d]pyrimidin-1-yl]-N-[2-(4-sulfamoylphenyl)ethyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C242-0423
2-[3-(3-methoxyphenyl)-5,6-dimethyl-2,4-dioxo-1H,2H,3H,4H-thieno[2,3-d]pyrimidin-1-yl]-N-[2-(4-sulfamoylphenyl)ethyl]acetamide

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

C242-0423

Molecular Formula

C25H26N4O6S2 (C25 H26 N4 O6 S2)

Compound Name

2-[3-(3-methoxyphenyl)-5,6-dimethyl-2,4-dioxo-1H,2H,3H,4H-thieno[2,3-d]pyrimidin-1-yl]-N-[2-(4-sulfamoylphenyl)ethyl]acetamide

IUPAC name

2-[3-(3-methoxyphenyl)-56-dimethyl-24-dioxo-1H2H3H4H-thieno[23-d]pyrimidin-1-yl]-N-[2-(4-sulfamoylphenyl)ethyl]acetamide

SMILES

Cc1c(C)sc(N(CC(NCCc(cc2)ccc2S(N)(=O)=O)=O)C(N2c3cc(OC)ccc3)=O)c1C2=O

InChI

InChI=1S/C25H26N4O6S2/c1-15-16(2)36-24-22(15)23(31)29(18-5-4-6-19(13-18)35-3)25(32)28(24)14-21(30)27-12-11-17-7-9-20(10-8-17)37(26,33)34/h4-10,13H,11-12,14H2,1-3H3,(H,27,30)(H2,26,33,34)

InChI Key

XCYXWELCNJSKPA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14735012

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

542.64

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

1.882

Distribution Coefficient, logD

1.881

Water Solubility, LogSw

-2.91

Polar Surface Area

113.567

Acid Dissociation Constant (pKa)

10.18

Base Dissociation Constant (pKb)

0.92

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

24.00

C242-0423 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with C242-0423 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C242-0423?
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What is the minimum amount of C242-0423 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C242-0423
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C242-0423
  • 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 C242-0423 available by request