ethyl 3'-cyano-5-methoxy-2-oxospiro[1-benzofuran-3,7'-1H-pyr
TL;DR: ethyl 3'-cyano-5-methoxy-2-oxospiro[1-benzofuran-3,7'-1H-pyr (CAS 80240-50-2) is a chemical compound with molecular formula C18H14N4O5 and molecular weight 366.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3'-cyano-5-methoxy-2-oxospiro[1-benzofuran-3,7'-4H-pyrazolo[1,5-a]pyrimidine]-6'-carboxylate
Also Known As: ethyl 3'-cyano-5-methoxy-2-oxospiro[1-benzofuran-3,7'-1H-pyr, Ethyl 3'-cyano-5-methoxy-2-oxo-1'H,2H-spiro[[1]benzofuran-3,7'-pyrazolo[1,5-a]pyrimidine]-6'-carboxylate, Ethyl 3'-cyano-5-methoxy-2-oxo-4'H-spiro[1-benzofuran-3,7'-pyrazolo[1,5-a]pyrimidine]-6'-carboxylate, ethyl 3'-cyano-5-methoxy-2-oxospiro[1-benzofuran-3,7'-1H-pyrazolo[1,5-a]pyrimidine]-6'-carboxylate, ethyl 3'-cyano-5-methoxy-2-oxospiro[1-benzofuran-3,7'-4H-pyrazolo[1,5-a]pyrimidine]-6'-carboxylate
| Molecular Formula | C18H14N4O5 |
|---|---|
| Molecular Weight | 366.10 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 115.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 366.0964 |
| Heavy Atoms | 27 |
| Complexity | 731.0 |
Chemical Identifiers
| CAS Number | 80240-50-2 |
|---|---|
| SMILES | CCOC(=O)C1=CNC2=C(C=NN2C13C4=C(C=CC(=C4)OC)OC3=O)C#N |
| InChIKey | WTYOOWPVGLURCT-UHFFFAOYSA-N |
Product Overview
ethyl 3'-cyano-5-methoxy-2-oxospiro[1-benzofuran-3,7'-1H-pyr (CAS 80240-50-2), with molecular formula C18H14N4O5 and molecular weight 366.10 g/mol. IUPAC: ethyl 3'-cyano-5-methoxy-2-oxospiro[1-benzofuran-3,7'-4H-pyrazolo[1,5-a]pyrimidine]-6'-carboxylate.
Chemical Property Profile of ethyl 3'-cyano-5-methoxy-2-oxospiro[1-benzofuran-3,7'-1H-pyr
Property Insights of ethyl 3'-cyano-5-methoxy-2-oxospiro[1-benzofuran-3,7'-1H-pyr
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 3'-cyano-5-methoxy-2-oxospiro[1-benzofuran-3,7'-1H-pyr. The TPSA of 115.0 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 3'-cyano-5-methoxy-2-oxospiro[1-benzofuran-3,7'-1H-pyr. Following Lipinski's Rule of Five, ethyl 3'-cyano-5-methoxy-2-oxospiro[1-benzofuran-3,7'-1H-pyr has 1 hydrogen bond donor(s) and 8 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 ethyl 3'-cyano-5-methoxy-2-oxospiro[1-benzofuran-3,7'-1H-pyr?
The CAS number of ethyl 3'-cyano-5-methoxy-2-oxospiro[1-benzofuran-3,7'-1H-pyr is 80240-50-2.
What is the molecular formula of ethyl 3'-cyano-5-methoxy-2-oxospiro[1-benzofuran-3,7'-1H-pyr?
The molecular formula of ethyl 3'-cyano-5-methoxy-2-oxospiro[1-benzofuran-3,7'-1H-pyr is C18H14N4O5.
What is the molecular weight of ethyl 3'-cyano-5-methoxy-2-oxospiro[1-benzofuran-3,7'-1H-pyr?
The molecular weight of ethyl 3'-cyano-5-methoxy-2-oxospiro[1-benzofuran-3,7'-1H-pyr is 366.10 g/mol.
Where can I buy ethyl 3'-cyano-5-methoxy-2-oxospiro[1-benzofuran-3,7'-1H-pyr?
You can request a quote for ethyl 3'-cyano-5-methoxy-2-oxospiro[1-benzofuran-3,7'-1H-pyr directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 3'-cyano-5-methoxy-2-oxospiro[1-benzofuran-3,7'-1H-pyr?
Yes, KEHONG BIO provides custom synthesis services for ethyl 3'-cyano-5-methoxy-2-oxospiro[1-benzofuran-3,7'-1H-pyr and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.