![ethyl [6'-amino-1-(4-chlorobenzyl)-5'-cyano-2-oxo-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazol]-3'-yl]acetate structure](/static/products/847/847337-27-3.png)
ethyl [6'-amino-1-(4-chlorobenzyl)-5'-cyano-2-oxo-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazol]-3'-yl]acetate
TL;DR: ethyl [6'-amino-1-(4-chlorobenzyl)-5'-cyano-2-oxo-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazol]-3'-yl]acetate (CAS 847337-27-3) is a chemical compound with molecular formula C25H20ClN5O4 and molecular weight 489.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[6-amino-1'-[(4-chlorophenyl)methyl]-5-cyano-2'-oxospiro[2H-pyrano[2,3-c]pyrazole-4,3'-indole]-3-yl]acetate
Also Known As: ethyl [6'-amino-1-(4-chlorobenzyl)-5'-cyano-2-oxo-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazol]-3'-yl]acetate, ethyl 2-(6'-amino-1-(4-chlorobenzyl)-5'-cyano-2-oxo-1'H-spiro[indoline-3,4'-pyrano[2,3-c]pyrazol]-3'-yl)acetate, ethyl 2-[6-amino-1'-[(4-chlorophenyl)methyl]-5-cyano-2'-oxospiro[2H-pyrano[2,3-c]pyrazole-4,3'-indole]-3-yl]acetate
| Molecular Formula | C25H20ClN5O4 |
|---|---|
| Molecular Weight | 489.12 g/mol |
| LogP | 3.08788 |
| Topological Polar Surface Area | 134.33 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 489.1204 |
| Heavy Atoms | 35 |
| Complexity | 1422.354 |
Chemical Identifiers
| CAS Number | 847337-27-3 |
|---|---|
| SMILES | CCOC(=O)CC1=C2C(=NN1)OC(=C(C23C4=CC=CC=C4N(C3=O)CC5=CC=C(C=C5)Cl)C#N)N |
Product Overview
ethyl [6'-amino-1-(4-chlorobenzyl)-5'-cyano-2-oxo-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazol]-3'-yl]acetate (CAS 847337-27-3), with molecular formula C25H20ClN5O4 and molecular weight 489.12 g/mol. IUPAC: ethyl 2-[6-amino-1'-[(4-chlorophenyl)methyl]-5-cyano-2'-oxospiro[2H-pyrano[2,3-c]pyrazole-4,3'-indole]-3-yl]acetate.
Chemical Property Profile of ethyl [6'-amino-1-(4-chlorobenzyl)-5'-cyano-2-oxo-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazol]-3'-yl]acetate
Property Insights of ethyl [6'-amino-1-(4-chlorobenzyl)-5'-cyano-2-oxo-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazol]-3'-yl]acetate
The XLogP value of 3.08788 indicates that ethyl [6'-amino-1-(4-chlorobenzyl)-5'-cyano-2-oxo-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazol]-3'-yl]acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 134.33 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl [6'-amino-1-(4-chlorobenzyl)-5'-cyano-2-oxo-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazol]-3'-yl]acetate. Following Lipinski's Rule of Five, ethyl [6'-amino-1-(4-chlorobenzyl)-5'-cyano-2-oxo-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazol]-3'-yl]acetate has 2 hydrogen bond donor(s) and 7 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 [6'-amino-1-(4-chlorobenzyl)-5'-cyano-2-oxo-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazol]-3'-yl]acetate?
The CAS number of ethyl [6'-amino-1-(4-chlorobenzyl)-5'-cyano-2-oxo-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazol]-3'-yl]acetate is 847337-27-3.
What is the molecular formula of ethyl [6'-amino-1-(4-chlorobenzyl)-5'-cyano-2-oxo-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazol]-3'-yl]acetate?
The molecular formula of ethyl [6'-amino-1-(4-chlorobenzyl)-5'-cyano-2-oxo-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazol]-3'-yl]acetate is C25H20ClN5O4.
What is the molecular weight of ethyl [6'-amino-1-(4-chlorobenzyl)-5'-cyano-2-oxo-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazol]-3'-yl]acetate?
The molecular weight of ethyl [6'-amino-1-(4-chlorobenzyl)-5'-cyano-2-oxo-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazol]-3'-yl]acetate is 489.12 g/mol.
Where can I buy ethyl [6'-amino-1-(4-chlorobenzyl)-5'-cyano-2-oxo-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazol]-3'-yl]acetate?
You can request a quote for ethyl [6'-amino-1-(4-chlorobenzyl)-5'-cyano-2-oxo-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazol]-3'-yl]acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl [6'-amino-1-(4-chlorobenzyl)-5'-cyano-2-oxo-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazol]-3'-yl]acetate?
Yes, KEHONG BIO provides custom synthesis services for ethyl [6'-amino-1-(4-chlorobenzyl)-5'-cyano-2-oxo-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazol]-3'-yl]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.