Phenylmethyl 2-[(2,4-dichlorophenyl)methylene]-2,3-dihydro-5-[3-methoxy-4-(2-propen-1-yloxy)phenyl]-7-methyl-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate
TL;DR: Phenylmethyl 2-[(2,4-dichlorophenyl)methylene]-2,3-dihydro-5-[3-methoxy-4-(2-propen-1-yloxy)phenyl]-7-methyl-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate (CAS 618092-35-6) is a chemical compound with molecular formula C32H26Cl2N2O5S and molecular weight 620.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl 2-[(2,4-dichlorophenyl)methylidene]-5-(3-methoxy-4-prop-2-enoxyphenyl)-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Also Known As: Phenylmethyl 2-[(2,4-dichlorophenyl)methylene]-2,3-dihydro-5-[3-methoxy-4-(2-propen-1-yloxy)phenyl]-7-methyl-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate, benzyl 2-[(2,4-dichlorophenyl)methylidene]-5-(3-methoxy-4-prop-2-enoxyphenyl)-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
| Molecular Formula | C32H26Cl2N2O5S |
|---|---|
| Molecular Weight | 620.09 g/mol |
| LogP | 5.8588 |
| Topological Polar Surface Area | 79.12 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 620.09393 |
| Heavy Atoms | 42 |
| Complexity | 1878.9781 |
Chemical Identifiers
| CAS Number | 618092-35-6 |
|---|---|
| SMILES | CC1=C(C(N2C(=O)C(=CC3=C(C=C(C=C3)Cl)Cl)SC2=N1)C4=CC(=C(C=C4)OCC=C)OC)C(=O)OCC5=CC=CC=C5 |
Product Overview
Phenylmethyl 2-[(2,4-dichlorophenyl)methylene]-2,3-dihydro-5-[3-methoxy-4-(2-propen-1-yloxy)phenyl]-7-methyl-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate (CAS 618092-35-6), with molecular formula C32H26Cl2N2O5S and molecular weight 620.09 g/mol. IUPAC: benzyl 2-[(2,4-dichlorophenyl)methylidene]-5-(3-methoxy-4-prop-2-enoxyphenyl)-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate.
Chemical Property Profile of Phenylmethyl 2-[(2,4-dichlorophenyl)methylene]-2,3-dihydro-5-[3-methoxy-4-(2-propen-1-yloxy)phenyl]-7-methyl-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate
Property Insights of Phenylmethyl 2-[(2,4-dichlorophenyl)methylene]-2,3-dihydro-5-[3-methoxy-4-(2-propen-1-yloxy)phenyl]-7-methyl-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate
The XLogP value of 5.8588 indicates that Phenylmethyl 2-[(2,4-dichlorophenyl)methylene]-2,3-dihydro-5-[3-methoxy-4-(2-propen-1-yloxy)phenyl]-7-methyl-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.12 Ų falls within the moderate polarity range, balancing permeability and solubility for Phenylmethyl 2-[(2,4-dichlorophenyl)methylene]-2,3-dihydro-5-[3-methoxy-4-(2-propen-1-yloxy)phenyl]-7-methyl-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate. Following Lipinski's Rule of Five, Phenylmethyl 2-[(2,4-dichlorophenyl)methylene]-2,3-dihydro-5-[3-methoxy-4-(2-propen-1-yloxy)phenyl]-7-methyl-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Phenylmethyl 2-[(2,4-dichlorophenyl)methylene]-2,3-dihydro-5-[3-methoxy-4-(2-propen-1-yloxy)phenyl]-7-methyl-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate?
The CAS number of Phenylmethyl 2-[(2,4-dichlorophenyl)methylene]-2,3-dihydro-5-[3-methoxy-4-(2-propen-1-yloxy)phenyl]-7-methyl-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate is 618092-35-6.
What is the molecular formula of Phenylmethyl 2-[(2,4-dichlorophenyl)methylene]-2,3-dihydro-5-[3-methoxy-4-(2-propen-1-yloxy)phenyl]-7-methyl-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate?
The molecular formula of Phenylmethyl 2-[(2,4-dichlorophenyl)methylene]-2,3-dihydro-5-[3-methoxy-4-(2-propen-1-yloxy)phenyl]-7-methyl-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate is C32H26Cl2N2O5S.
What is the molecular weight of Phenylmethyl 2-[(2,4-dichlorophenyl)methylene]-2,3-dihydro-5-[3-methoxy-4-(2-propen-1-yloxy)phenyl]-7-methyl-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate?
The molecular weight of Phenylmethyl 2-[(2,4-dichlorophenyl)methylene]-2,3-dihydro-5-[3-methoxy-4-(2-propen-1-yloxy)phenyl]-7-methyl-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate is 620.09 g/mol.
Where can I buy Phenylmethyl 2-[(2,4-dichlorophenyl)methylene]-2,3-dihydro-5-[3-methoxy-4-(2-propen-1-yloxy)phenyl]-7-methyl-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate?
You can request a quote for Phenylmethyl 2-[(2,4-dichlorophenyl)methylene]-2,3-dihydro-5-[3-methoxy-4-(2-propen-1-yloxy)phenyl]-7-methyl-3-oxo-5H-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 Phenylmethyl 2-[(2,4-dichlorophenyl)methylene]-2,3-dihydro-5-[3-methoxy-4-(2-propen-1-yloxy)phenyl]-7-methyl-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Phenylmethyl 2-[(2,4-dichlorophenyl)methylene]-2,3-dihydro-5-[3-methoxy-4-(2-propen-1-yloxy)phenyl]-7-methyl-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.