C241-1191 Screening compound: 1-[(4-tert-butylphenyl)methyl]-3-(3,5-dimethylphenyl)-1H,2H,3H,4H-thieno[3,2-d]pyrimidine-2,4-dione

C241-1191 Screening compound: 1-[(4-tert-butylphenyl)methyl]-3-(3,5-dimethylphenyl)-1H,2H,3H,4H-thieno[3,2-d]pyrimidine-2,4-dione
C241-1191 Screening compound: 1-[(4-tert-butylphenyl)methyl]-3-(3,5-dimethylphenyl)-1H,2H,3H,4H-thieno[3,2-d]pyrimidine-2,4-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound C241-1191
1-[(4-tert-butylphenyl)methyl]-3-(3,5-dimethylphenyl)-1H,2H,3H,4H-thieno[3,2-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

C241-1191

Molecular Formula

C25H26N2O2S (C25 H26 N2 O2 S)

Compound Name

1-[(4-tert-butylphenyl)methyl]-3-(3,5-dimethylphenyl)-1H,2H,3H,4H-thieno[3,2-d]pyrimidine-2,4-dione

IUPAC name

1-[(4-tert-butylphenyl)methyl]-3-(35-dimethylphenyl)-1H2H3H4H-thieno[32-d]pyrimidine-24-dione

SMILES

CC(C)(C)c1ccc(CN(c2c(C(N3c4cc(C)cc(C)c4)=O)scc2)C3=O)cc1

InChI

InChI=1S/C25H26N2O2S/c1-16-12-17(2)14-20(13-16)27-23(28)22-21(10-11-30-22)26(24(27)29)15-18-6-8-19(9-7-18)25(3,4)5/h6-14H,15H2,1-5H3

InChI Key

WASJRJLUKAQIIY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14734255

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

418.56

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.740

Distribution Coefficient, logD

6.740

Water Solubility, LogSw

-5.56

Polar Surface Area

31.674

Acid Dissociation Constant (pKa)

28.58

Base Dissociation Constant (pKb)

-4.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.00

C241-1191 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 C241-1191 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C241-1191?
Check Price and Availability of C241-1191, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of C241-1191 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C241-1191
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C241-1191
  • 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 C241-1191 available by request