![ethyl 1'-allyl-6-amino-3-methyl-2-oxo-1,1',3',4-tetrahydrospiro(pyrano[2,3-c]pyrazole-4,3'-[2'H]-indole)-5-carboxylate structure](/static/products/4452/445223-07-4.webp)
ethyl 1'-allyl-6-amino-3-methyl-2-oxo-1,1',3',4-tetrahydrospiro(pyrano[2,3-c]pyrazole-4,3'-[2'H]-indole)-5-carboxylate
TL;DR: ethyl 1'-allyl-6-amino-3-methyl-2-oxo-1,1',3',4-tetrahydrospiro(pyrano[2,3-c]pyrazole-4,3'-[2'H]-indole)-5-carboxylate (CAS 445223-07-4) is a chemical compound with molecular formula C20H20N4O4 and molecular weight 380.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 6-amino-3-methyl-2'-oxo-1'-prop-2-enylspiro[2H-pyrano[2,3-c]pyrazole-4,3'-indole]-5-carboxylate
Also Known As: ethyl 1'-allyl-6-amino-3-methyl-2-oxo-1,1',3',4-tetrahydrospiro(pyrano[2,3-c]pyrazole-4,3'-[2'H]-indole)-5-carboxylate, ethyl 6-amino-3-methyl-2'-oxo-1'-prop-2-enylspiro[2H-pyrano[2,3-c]pyrazole-4,3'-indole]-5-carboxylate, ethyl 1-allyl-6'-amino-3'-methyl-2-oxo-1'H-spiro[indoline-3,4'-pyrano[2,3-c]pyrazole]-5'-carboxylate, ethyl 6'-amino-3'-methyl-2-oxo-1-(prop-2-en-1-yl)-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carboxylate
| Molecular Formula | C20H20N4O4 |
|---|---|
| Molecular Weight | 380.15 g/mol |
| LogP | 1.66262 |
| Topological Polar Surface Area | 110.54 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 380.14847 |
| Heavy Atoms | 28 |
| Complexity | 1038.5767 |
Chemical Identifiers
| CAS Number | 445223-07-4 |
|---|---|
| SMILES | CCOC(=O)C1=C(OC2=NNC(=C2C13C4=CC=CC=C4N(C3=O)CC=C)C)N |
Product Overview
ethyl 1'-allyl-6-amino-3-methyl-2-oxo-1,1',3',4-tetrahydrospiro(pyrano[2,3-c]pyrazole-4,3'-[2'H]-indole)-5-carboxylate (CAS 445223-07-4), with molecular formula C20H20N4O4 and molecular weight 380.15 g/mol. IUPAC: ethyl 6-amino-3-methyl-2'-oxo-1'-prop-2-enylspiro[2H-pyrano[2,3-c]pyrazole-4,3'-indole]-5-carboxylate.
Chemical Property Profile of ethyl 1'-allyl-6-amino-3-methyl-2-oxo-1,1',3',4-tetrahydrospiro(pyrano[2,3-c]pyrazole-4,3'-[2'H]-indole)-5-carboxylate
Property Insights of ethyl 1'-allyl-6-amino-3-methyl-2-oxo-1,1',3',4-tetrahydrospiro(pyrano[2,3-c]pyrazole-4,3'-[2'H]-indole)-5-carboxylate
The XLogP value of 1.66262 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 1'-allyl-6-amino-3-methyl-2-oxo-1,1',3',4-tetrahydrospiro(pyrano[2,3-c]pyrazole-4,3'-[2'H]-indole)-5-carboxylate. The TPSA of 110.54 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 1'-allyl-6-amino-3-methyl-2-oxo-1,1',3',4-tetrahydrospiro(pyrano[2,3-c]pyrazole-4,3'-[2'H]-indole)-5-carboxylate. Following Lipinski's Rule of Five, ethyl 1'-allyl-6-amino-3-methyl-2-oxo-1,1',3',4-tetrahydrospiro(pyrano[2,3-c]pyrazole-4,3'-[2'H]-indole)-5-carboxylate has 2 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 ethyl 1'-allyl-6-amino-3-methyl-2-oxo-1,1',3',4-tetrahydrospiro(pyrano[2,3-c]pyrazole-4,3'-[2'H]-indole)-5-carboxylate?
The CAS number of ethyl 1'-allyl-6-amino-3-methyl-2-oxo-1,1',3',4-tetrahydrospiro(pyrano[2,3-c]pyrazole-4,3'-[2'H]-indole)-5-carboxylate is 445223-07-4.
What is the molecular formula of ethyl 1'-allyl-6-amino-3-methyl-2-oxo-1,1',3',4-tetrahydrospiro(pyrano[2,3-c]pyrazole-4,3'-[2'H]-indole)-5-carboxylate?
The molecular formula of ethyl 1'-allyl-6-amino-3-methyl-2-oxo-1,1',3',4-tetrahydrospiro(pyrano[2,3-c]pyrazole-4,3'-[2'H]-indole)-5-carboxylate is C20H20N4O4.
What is the molecular weight of ethyl 1'-allyl-6-amino-3-methyl-2-oxo-1,1',3',4-tetrahydrospiro(pyrano[2,3-c]pyrazole-4,3'-[2'H]-indole)-5-carboxylate?
The molecular weight of ethyl 1'-allyl-6-amino-3-methyl-2-oxo-1,1',3',4-tetrahydrospiro(pyrano[2,3-c]pyrazole-4,3'-[2'H]-indole)-5-carboxylate is 380.15 g/mol.
Where can I buy ethyl 1'-allyl-6-amino-3-methyl-2-oxo-1,1',3',4-tetrahydrospiro(pyrano[2,3-c]pyrazole-4,3'-[2'H]-indole)-5-carboxylate?
You can request a quote for ethyl 1'-allyl-6-amino-3-methyl-2-oxo-1,1',3',4-tetrahydrospiro(pyrano[2,3-c]pyrazole-4,3'-[2'H]-indole)-5-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 1'-allyl-6-amino-3-methyl-2-oxo-1,1',3',4-tetrahydrospiro(pyrano[2,3-c]pyrazole-4,3'-[2'H]-indole)-5-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 1'-allyl-6-amino-3-methyl-2-oxo-1,1',3',4-tetrahydrospiro(pyrano[2,3-c]pyrazole-4,3'-[2'H]-indole)-5-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.