![(Z)-ethyl 4-(5-((5-imino-2-methyl-7-oxo-5H-thiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl)furan-2-yl)benzoate structure](/static/products/877/877806-76-3.png)
(Z)-ethyl 4-(5-((5-imino-2-methyl-7-oxo-5H-thiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl)furan-2-yl)benzoate
TL;DR: (Z)-ethyl 4-(5-((5-imino-2-methyl-7-oxo-5H-thiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl)furan-2-yl)benzoate (CAS 877806-76-3) is a chemical compound with molecular formula C21H17N3O4S and molecular weight 407.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[5-[(Z)-(5-imino-2-methyl-7-oxo-[1,3]thiazolo[3,2-a]pyrimidin-6-ylidene)methyl]furan-2-yl]benzoate
Also Known As: (Z)-ethyl 4-(5-((5-imino-2-methyl-7-oxo-5H-thiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl)furan-2-yl)benzoate, ethyl 4-[5-[(Z)-(5-imino-2-methyl-7-oxo-[1,3]thiazolo[3,2-a]pyrimidin-6-ylidene)methyl]furan-2-yl]benzoate
| Molecular Formula | C21H17N3O4S |
|---|---|
| Molecular Weight | 407.09 g/mol |
| LogP | 4.29027 |
| Topological Polar Surface Area | 95.96 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 407.09396 |
| Heavy Atoms | 29 |
| Complexity | 1109.2009 |
Chemical Identifiers
| CAS Number | 877806-76-3 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)/C=C\3/C(=N)N4C=C(SC4=NC3=O)C |
Product Overview
(Z)-ethyl 4-(5-((5-imino-2-methyl-7-oxo-5H-thiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl)furan-2-yl)benzoate (CAS 877806-76-3), with molecular formula C21H17N3O4S and molecular weight 407.09 g/mol. IUPAC: ethyl 4-[5-[(Z)-(5-imino-2-methyl-7-oxo-[1,3]thiazolo[3,2-a]pyrimidin-6-ylidene)methyl]furan-2-yl]benzoate.
Chemical Property Profile of (Z)-ethyl 4-(5-((5-imino-2-methyl-7-oxo-5H-thiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl)furan-2-yl)benzoate
Property Insights of (Z)-ethyl 4-(5-((5-imino-2-methyl-7-oxo-5H-thiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl)furan-2-yl)benzoate
The XLogP value of 4.29027 indicates that (Z)-ethyl 4-(5-((5-imino-2-methyl-7-oxo-5H-thiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl)furan-2-yl)benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.96 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-ethyl 4-(5-((5-imino-2-methyl-7-oxo-5H-thiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl)furan-2-yl)benzoate. Following Lipinski's Rule of Five, (Z)-ethyl 4-(5-((5-imino-2-methyl-7-oxo-5H-thiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl)furan-2-yl)benzoate has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (Z)-ethyl 4-(5-((5-imino-2-methyl-7-oxo-5H-thiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl)furan-2-yl)benzoate?
The CAS number of (Z)-ethyl 4-(5-((5-imino-2-methyl-7-oxo-5H-thiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl)furan-2-yl)benzoate is 877806-76-3.
What is the molecular formula of (Z)-ethyl 4-(5-((5-imino-2-methyl-7-oxo-5H-thiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl)furan-2-yl)benzoate?
The molecular formula of (Z)-ethyl 4-(5-((5-imino-2-methyl-7-oxo-5H-thiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl)furan-2-yl)benzoate is C21H17N3O4S.
What is the molecular weight of (Z)-ethyl 4-(5-((5-imino-2-methyl-7-oxo-5H-thiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl)furan-2-yl)benzoate?
The molecular weight of (Z)-ethyl 4-(5-((5-imino-2-methyl-7-oxo-5H-thiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl)furan-2-yl)benzoate is 407.09 g/mol.
Where can I buy (Z)-ethyl 4-(5-((5-imino-2-methyl-7-oxo-5H-thiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl)furan-2-yl)benzoate?
You can request a quote for (Z)-ethyl 4-(5-((5-imino-2-methyl-7-oxo-5H-thiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl)furan-2-yl)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-ethyl 4-(5-((5-imino-2-methyl-7-oxo-5H-thiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl)furan-2-yl)benzoate?
Yes, KEHONG BIO provides custom synthesis services for (Z)-ethyl 4-(5-((5-imino-2-methyl-7-oxo-5H-thiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl)furan-2-yl)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.