3202-0250 Screening compound: ethyl (2E)-2-[(4-{2-[4-(butan-2-yl)phenoxy]ethoxy}phenyl)methylidene]-5-(4-methoxyphenyl)-7-methyl-3-oxo-2H,3H,5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

3202-0250 Screening compound: ethyl (2E)-2-[(4-{2-[4-(butan-2-yl)phenoxy]ethoxy}phenyl)methylidene]-5-(4-methoxyphenyl)-7-methyl-3-oxo-2H,3H,5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
3202-0250 Screening compound: ethyl (2E)-2-[(4-{2-[4-(butan-2-yl)phenoxy]ethoxy}phenyl)methylidene]-5-(4-methoxyphenyl)-7-methyl-3-oxo-2H,3H,5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 3202-0250
ethyl (2E)-2-[(4-{2-[4-(butan-2-yl)phenoxy]ethoxy}phenyl)methylidene]-5-(4-methoxyphenyl)-7-methyl-3-oxo-2H,3H,5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

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

3202-0250

Molecular Formula

C36H38N2O6S (C36 H38 N2 O6 S)

Compound Name

ethyl (2E)-2-[(4-{2-[4-(butan-2-yl)phenoxy]ethoxy}phenyl)methylidene]-5-(4-methoxyphenyl)-7-methyl-3-oxo-2H,3H,5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

IUPAC name

ethyl (2E)-2-[(4-{2-[4-(butan-2-yl)phenoxy]ethoxy}phenyl)methylidene]-5-(4-methoxyphenyl)-7-methyl-3-oxo-2H3H5H-[13]thiazolo[32-a]pyrimidine-6-carboxylate

SMILES

CCC(C)c(cc1)ccc1OCCOc1ccc(/C=C(\C(N2C3c(cc4)ccc4OC)=O)/SC2=NC(C)=C3C(OCC)=O)cc1

InChI

InChI=1S/C36H38N2O6S/c1-6-23(3)26-10-18-30(19-11-26)44-21-20-43-29-14-8-25(9-15-29)22-31-34(39)38-33(27-12-16-28(41-5)17-13-27)32(35(40)42-7-2)24(4)37-36(38)45-31/h8-19,22-23,33H,6-7,20-21H2,1-5H3

InChI Key

IPGNIGZWWIMFGR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02017591

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

626.77

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

7.858

Distribution Coefficient, logD

7.858

Water Solubility, LogSw

-5.74

Polar Surface Area

67.855

Acid Dissociation Constant (pKa)

24.43

Base Dissociation Constant (pKb)

2.54

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

30.60

3202-0250 in Drug Discovery

Included in Screening Libraries

Lipid Metabolism Library (9174 compounds)

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

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 3202-0250 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3202-0250?
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What is the minimum amount of 3202-0250 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3202-0250
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3202-0250
  • 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 3202-0250 available by request