(Z)-methyl 5-(4-acetoxyphenyl)-2-(2,3-dimethoxybenzylidene)-7-methyl-3-oxo-3,5-dihydro-2H-thiazolo[3,2-a]pyrimidine-6-carboxylate
TL;DR: (Z)-methyl 5-(4-acetoxyphenyl)-2-(2,3-dimethoxybenzylidene)-7-methyl-3-oxo-3,5-dihydro-2H-thiazolo[3,2-a]pyrimidine-6-carboxylate (CAS 372501-33-2) is a chemical compound with molecular formula C26H24N2O7S and molecular weight 508.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (2Z)-5-(4-acetyloxyphenyl)-2-[(2,3-dimethoxyphenyl)methylidene]-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Also Known As: (Z)-methyl 5-(4-acetoxyphenyl)-2-(2,3-dimethoxybenzylidene)-7-methyl-3-oxo-3,5-dihydro-2H-thiazolo[3,2-a]pyrimidine-6-carboxylate, methyl (2Z)-5-(4-acetyloxyphenyl)-2-[(2,3-dimethoxyphenyl)methylidene]-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate, methyl (2Z)-5-[4-(acetyloxy)phenyl]-2-(2,3-dimethoxybenzylidene)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
| Molecular Formula | C26H24N2O7S |
|---|---|
| Molecular Weight | 508.13 g/mol |
| LogP | 2.3507 |
| Topological Polar Surface Area | 105.42 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 508.13043 |
| Heavy Atoms | 36 |
| Complexity | 1548.2784 |
Chemical Identifiers
| CAS Number | 372501-33-2 |
|---|---|
| SMILES | CC1=C(C(N2C(=O)/C(=C/C3=C(C(=CC=C3)OC)OC)/SC2=N1)C4=CC=C(C=C4)OC(=O)C)C(=O)OC |
Product Overview
(Z)-methyl 5-(4-acetoxyphenyl)-2-(2,3-dimethoxybenzylidene)-7-methyl-3-oxo-3,5-dihydro-2H-thiazolo[3,2-a]pyrimidine-6-carboxylate (CAS 372501-33-2), with molecular formula C26H24N2O7S and molecular weight 508.13 g/mol. IUPAC: methyl (2Z)-5-(4-acetyloxyphenyl)-2-[(2,3-dimethoxyphenyl)methylidene]-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate.
Chemical Property Profile of (Z)-methyl 5-(4-acetoxyphenyl)-2-(2,3-dimethoxybenzylidene)-7-methyl-3-oxo-3,5-dihydro-2H-thiazolo[3,2-a]pyrimidine-6-carboxylate
Property Insights of (Z)-methyl 5-(4-acetoxyphenyl)-2-(2,3-dimethoxybenzylidene)-7-methyl-3-oxo-3,5-dihydro-2H-thiazolo[3,2-a]pyrimidine-6-carboxylate
The XLogP value of 2.3507 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (Z)-methyl 5-(4-acetoxyphenyl)-2-(2,3-dimethoxybenzylidene)-7-methyl-3-oxo-3,5-dihydro-2H-thiazolo[3,2-a]pyrimidine-6-carboxylate. The TPSA of 105.42 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-methyl 5-(4-acetoxyphenyl)-2-(2,3-dimethoxybenzylidene)-7-methyl-3-oxo-3,5-dihydro-2H-thiazolo[3,2-a]pyrimidine-6-carboxylate. Following Lipinski's Rule of Five, (Z)-methyl 5-(4-acetoxyphenyl)-2-(2,3-dimethoxybenzylidene)-7-methyl-3-oxo-3,5-dihydro-2H-thiazolo[3,2-a]pyrimidine-6-carboxylate has 0 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (Z)-methyl 5-(4-acetoxyphenyl)-2-(2,3-dimethoxybenzylidene)-7-methyl-3-oxo-3,5-dihydro-2H-thiazolo[3,2-a]pyrimidine-6-carboxylate?
The CAS number of (Z)-methyl 5-(4-acetoxyphenyl)-2-(2,3-dimethoxybenzylidene)-7-methyl-3-oxo-3,5-dihydro-2H-thiazolo[3,2-a]pyrimidine-6-carboxylate is 372501-33-2.
What is the molecular formula of (Z)-methyl 5-(4-acetoxyphenyl)-2-(2,3-dimethoxybenzylidene)-7-methyl-3-oxo-3,5-dihydro-2H-thiazolo[3,2-a]pyrimidine-6-carboxylate?
The molecular formula of (Z)-methyl 5-(4-acetoxyphenyl)-2-(2,3-dimethoxybenzylidene)-7-methyl-3-oxo-3,5-dihydro-2H-thiazolo[3,2-a]pyrimidine-6-carboxylate is C26H24N2O7S.
What is the molecular weight of (Z)-methyl 5-(4-acetoxyphenyl)-2-(2,3-dimethoxybenzylidene)-7-methyl-3-oxo-3,5-dihydro-2H-thiazolo[3,2-a]pyrimidine-6-carboxylate?
The molecular weight of (Z)-methyl 5-(4-acetoxyphenyl)-2-(2,3-dimethoxybenzylidene)-7-methyl-3-oxo-3,5-dihydro-2H-thiazolo[3,2-a]pyrimidine-6-carboxylate is 508.13 g/mol.
Where can I buy (Z)-methyl 5-(4-acetoxyphenyl)-2-(2,3-dimethoxybenzylidene)-7-methyl-3-oxo-3,5-dihydro-2H-thiazolo[3,2-a]pyrimidine-6-carboxylate?
You can request a quote for (Z)-methyl 5-(4-acetoxyphenyl)-2-(2,3-dimethoxybenzylidene)-7-methyl-3-oxo-3,5-dihydro-2H-thiazolo[3,2-a]pyrimidine-6-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-methyl 5-(4-acetoxyphenyl)-2-(2,3-dimethoxybenzylidene)-7-methyl-3-oxo-3,5-dihydro-2H-thiazolo[3,2-a]pyrimidine-6-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for (Z)-methyl 5-(4-acetoxyphenyl)-2-(2,3-dimethoxybenzylidene)-7-methyl-3-oxo-3,5-dihydro-2H-thiazolo[3,2-a]pyrimidine-6-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.