C200-0535 Screening compound: 3-(3,4-dimethylphenyl)-1-(2-oxo-2-phenylethyl)-1,5,6,7-tetrahydro-2H-cyclopenta[4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione

C200-0535 Screening compound: 3-(3,4-dimethylphenyl)-1-(2-oxo-2-phenylethyl)-1,5,6,7-tetrahydro-2H-cyclopenta[4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione
C200-0535 Screening compound: 3-(3,4-dimethylphenyl)-1-(2-oxo-2-phenylethyl)-1,5,6,7-tetrahydro-2H-cyclopenta[4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound C200-0535
3-(3,4-dimethylphenyl)-1-(2-oxo-2-phenylethyl)-1,5,6,7-tetrahydro-2H-cyclopenta[4,5]thieno[2,3-d]pyrimidine-2,4(3H)-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

C200-0535

Molecular Formula

C25H22N2O3S (C25 H22 N2 O3 S)

Compound Name

3-(3,4-dimethylphenyl)-1-(2-oxo-2-phenylethyl)-1,5,6,7-tetrahydro-2H-cyclopenta[4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione

IUPAC name

11-(34-dimethylphenyl)-9-(2-oxo-2-phenylethyl)-7-thia-911-diazatricyclo[6.4.0.0^{26}]dodeca-1(8)2(6)-diene-1012-dione

SMILES

Cc(cc1)c(C)cc1N(C(c1c(N2CC(c3ccccc3)=O)sc3c1CCC3)=O)C2=O

InChI

InChI=1S/C25H22N2O3S/c1-15-11-12-18(13-16(15)2)27-23(29)22-19-9-6-10-21(19)31-24(22)26(25(27)30)14-20(28)17-7-4-3-5-8-17/h3-5,7-8,11-13H,6,9-10,14H2,1-2H3

InChI Key

KWXFNKJFHHZEII-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14725594

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

430.53

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.023

Distribution Coefficient, logD

5.023

Water Solubility, LogSw

-4.79

Polar Surface Area

44.640

Acid Dissociation Constant (pKa)

19.56

Base Dissociation Constant (pKb)

-9.48

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

24.00

C200-0535 in Drug Discovery

Included in Screening Libraries

Protein Arginine Methyltransferases Library (27925 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • 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 C200-0535 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C200-0535?
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What is the minimum amount of C200-0535 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C200-0535
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C200-0535
  • 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 C200-0535 available by request