C242-0948 Screening compound: 1-[2-(4-chlorophenyl)-2-oxoethyl]-5,6-dimethyl-3-(2-phenylethyl)-1H,2H,3H,4H-thieno[2,3-d]pyrimidine-2,4-dione

C242-0948 Screening compound: 1-[2-(4-chlorophenyl)-2-oxoethyl]-5,6-dimethyl-3-(2-phenylethyl)-1H,2H,3H,4H-thieno[2,3-d]pyrimidine-2,4-dione
C242-0948 Screening compound: 1-[2-(4-chlorophenyl)-2-oxoethyl]-5,6-dimethyl-3-(2-phenylethyl)-1H,2H,3H,4H-thieno[2,3-d]pyrimidine-2,4-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound C242-0948
1-[2-(4-chlorophenyl)-2-oxoethyl]-5,6-dimethyl-3-(2-phenylethyl)-1H,2H,3H,4H-thieno[2,3-d]pyrimidine-2,4-dione

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

C242-0948

Molecular Formula

C24H21ClN2O3S (C24 H21 ClN2 O3 S)

Compound Name

1-[2-(4-chlorophenyl)-2-oxoethyl]-5,6-dimethyl-3-(2-phenylethyl)-1H,2H,3H,4H-thieno[2,3-d]pyrimidine-2,4-dione

IUPAC name

1-[2-(4-chlorophenyl)-2-oxoethyl]-56-dimethyl-3-(2-phenylethyl)-1H2H3H4H-thieno[23-d]pyrimidine-24-dione

SMILES

Cc1c(C)sc(N(CC(c(cc2)ccc2Cl)=O)C(N2CCc3ccccc3)=O)c1C2=O

InChI

InChI=1S/C24H21ClN2O3S/c1-15-16(2)31-23-21(15)22(29)26(13-12-17-6-4-3-5-7-17)24(30)27(23)14-20(28)18-8-10-19(25)11-9-18/h3-11H,12-14H2,1-2H3

InChI Key

UOIWPVQEQQNVTL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14735076

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

452.96

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.398

Distribution Coefficient, logD

5.398

Water Solubility, LogSw

-6.09

Polar Surface Area

44.944

Acid Dissociation Constant (pKa)

19.05

Base Dissociation Constant (pKb)

-11.82

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.80

C242-0948 in Drug Discovery

Included in Screening Libraries

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with C242-0948 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C242-0948?
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What is the minimum amount of C242-0948 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C242-0948
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C242-0948
  • 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 C242-0948 available by request