C200-0918 Screening compound: benzyl 2-[5,6-dimethyl-2,4-dioxo-3-(2-phenylethyl)-1H,2H,3H,4H-thieno[2,3-d]pyrimidin-1-yl]acetate

C200-0918 Screening compound: benzyl 2-[5,6-dimethyl-2,4-dioxo-3-(2-phenylethyl)-1H,2H,3H,4H-thieno[2,3-d]pyrimidin-1-yl]acetate
C200-0918 Screening compound: benzyl 2-[5,6-dimethyl-2,4-dioxo-3-(2-phenylethyl)-1H,2H,3H,4H-thieno[2,3-d]pyrimidin-1-yl]acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound C200-0918
benzyl 2-[5,6-dimethyl-2,4-dioxo-3-(2-phenylethyl)-1H,2H,3H,4H-thieno[2,3-d]pyrimidin-1-yl]acetate

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

C200-0918

Molecular Formula

C25H24N2O4S (C25 H24 N2 O4 S)

Compound Name

benzyl 2-[5,6-dimethyl-2,4-dioxo-3-(2-phenylethyl)-1H,2H,3H,4H-thieno[2,3-d]pyrimidin-1-yl]acetate

IUPAC name

benzyl 2-[56-dimethyl-24-dioxo-3-(2-phenylethyl)-1H2H3H4H-thieno[23-d]pyrimidin-1-yl]acetate

SMILES

Cc1c(C)sc(N(CC(OCc2ccccc2)=O)C(N2CCc3ccccc3)=O)c1C2=O

InChI

InChI=1S/C25H24N2O4S/c1-17-18(2)32-24-22(17)23(29)26(14-13-19-9-5-3-6-10-19)25(30)27(24)15-21(28)31-16-20-11-7-4-8-12-20/h3-12H,13-16H2,1-2H3

InChI Key

VOVVIJWKLYMOKT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14725789

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

448.54

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.155

Distribution Coefficient, logD

5.155

Water Solubility, LogSw

-5.21

Polar Surface Area

52.231

Acid Dissociation Constant (pKa)

21.42

Base Dissociation Constant (pKb)

-10.87

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

24.00

C200-0918 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

MCL1 Targeted Library (12200 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with C200-0918 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C200-0918?
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What is the minimum amount of C200-0918 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C200-0918
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C200-0918
  • 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 C200-0918 available by request