4376-0396 Screening compound: ethyl (2E)-7-methyl-3-oxo-5-(thiophen-2-yl)-2-[(2,4,5-trimethoxyphenyl)methylidene]-2H,3H,5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

4376-0396 Screening compound: ethyl (2E)-7-methyl-3-oxo-5-(thiophen-2-yl)-2-[(2,4,5-trimethoxyphenyl)methylidene]-2H,3H,5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
4376-0396 Screening compound: ethyl (2E)-7-methyl-3-oxo-5-(thiophen-2-yl)-2-[(2,4,5-trimethoxyphenyl)methylidene]-2H,3H,5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 4376-0396
ethyl (2E)-7-methyl-3-oxo-5-(thiophen-2-yl)-2-[(2,4,5-trimethoxyphenyl)methylidene]-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

4376-0396

Molecular Formula

C24H24N2O6S2 (C24 H24 N2 O6 S2)

Compound Name

ethyl (2E)-7-methyl-3-oxo-5-(thiophen-2-yl)-2-[(2,4,5-trimethoxyphenyl)methylidene]-2H,3H,5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

IUPAC name

ethyl (2E)-7-methyl-3-oxo-5-(thiophen-2-yl)-2-[(245-trimethoxyphenyl)methylidene]-2H3H5H-[13]thiazolo[32-a]pyrimidine-6-carboxylate

SMILES

CCOC(C(C(c1cccs1)N1C2=O)=C(C)N=C1S/C2=C/c(cc(c(OC)c1)OC)c1OC)=O

InChI

InChI=1S/C24H24N2O6S2/c1-6-32-23(28)20-13(2)25-24-26(21(20)18-8-7-9-33-18)22(27)19(34-24)11-14-10-16(30-4)17(31-5)12-15(14)29-3/h7-12,21H,6H2,1-5H3/t21-/m1/s1

InChI Key

IAZLRWOKJOUXIZ-OAQYLSRUSA-N

MDL Number (MFCD)

MFCD02373932

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

500.6

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.615

Distribution Coefficient, logD

3.615

Water Solubility, LogSw

-3.69

Polar Surface Area

69.657

Acid Dissociation Constant (pKa)

27.50

Base Dissociation Constant (pKb)

2.81

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

29.20

References: we are preparing a list of scientific research reports with 4376-0396 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4376-0396?
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What is the minimum amount of 4376-0396 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4376-0396
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4376-0396
  • 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 4376-0396 available by request