![ethyl 2-amino-4',4',6',9'-tetramethyl-2',5-dioxo-2',4',5,6,7,8-hexahydrospiro[chromene-4,1'-pyrrolo[3,2,1-ij]quinoline]-3-carboxylate structure](/static/products/896/896839-91-1.png)
ethyl 2-amino-4',4',6',9'-tetramethyl-2',5-dioxo-2',4',5,6,7,8-hexahydrospiro[chromene-4,1'-pyrrolo[3,2,1-ij]quinoline]-3-carboxylate
TL;DR: ethyl 2-amino-4',4',6',9'-tetramethyl-2',5-dioxo-2',4',5,6,7,8-hexahydrospiro[chromene-4,1'-pyrrolo[3,2,1-ij]quinoline]-3-carboxylate (CAS 896839-91-1) is a chemical compound with molecular formula C26H28N2O5 and molecular weight 448.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2'-amino-5,9,11,11-tetramethyl-2,5'-dioxospiro[1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12),9-tetraene-3,4'-7,8-dihydro-6H-chromene]-3'-carboxylate
Also Known As: ethyl 2-amino-4',4',6',9'-tetramethyl-2',5-dioxo-2',4',5,6,7,8-hexahydrospiro[chromene-4,1'-pyrrolo[3,2,1-ij]quinoline]-3-carboxylate, ethyl 2-amino-4',4',6',9'-tetramethyl-2',5-dioxo-5,6,7,8-tetrahydro-4'H-spiro[chromene-4,1'-pyrrolo[3,2,1-ij]quinoline]-3-carboxylate
| Molecular Formula | C26H28N2O5 |
|---|---|
| Molecular Weight | 448.20 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 98.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 448.19983 |
| Heavy Atoms | 33 |
| Complexity | 1050.0 |
Chemical Identifiers
| CAS Number | 896839-91-1 |
|---|---|
| SMILES | CCOC(=O)C1=C(OC2=C(C13C4=C(C=CC5=C4N(C3=O)C(C=C5C)(C)C)C)C(=O)CCC2)N |
| InChIKey | QQXKAAISZOUIHS-UHFFFAOYSA-N |
Product Overview
ethyl 2-amino-4',4',6',9'-tetramethyl-2',5-dioxo-2',4',5,6,7,8-hexahydrospiro[chromene-4,1'-pyrrolo[3,2,1-ij]quinoline]-3-carboxylate (CAS 896839-91-1), with molecular formula C26H28N2O5 and molecular weight 448.20 g/mol. IUPAC: ethyl 2'-amino-5,9,11,11-tetramethyl-2,5'-dioxospiro[1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12),9-tetraene-3,4'-7,8-dihydro-6H-chromene]-3'-carboxylate.
Chemical Property Profile of ethyl 2-amino-4',4',6',9'-tetramethyl-2',5-dioxo-2',4',5,6,7,8-hexahydrospiro[chromene-4,1'-pyrrolo[3,2,1-ij]quinoline]-3-carboxylate
Property Insights of ethyl 2-amino-4',4',6',9'-tetramethyl-2',5-dioxo-2',4',5,6,7,8-hexahydrospiro[chromene-4,1'-pyrrolo[3,2,1-ij]quinoline]-3-carboxylate
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 2-amino-4',4',6',9'-tetramethyl-2',5-dioxo-2',4',5,6,7,8-hexahydrospiro[chromene-4,1'-pyrrolo[3,2,1-ij]quinoline]-3-carboxylate. The TPSA of 98.9 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 2-amino-4',4',6',9'-tetramethyl-2',5-dioxo-2',4',5,6,7,8-hexahydrospiro[chromene-4,1'-pyrrolo[3,2,1-ij]quinoline]-3-carboxylate. Following Lipinski's Rule of Five, ethyl 2-amino-4',4',6',9'-tetramethyl-2',5-dioxo-2',4',5,6,7,8-hexahydrospiro[chromene-4,1'-pyrrolo[3,2,1-ij]quinoline]-3-carboxylate 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 ethyl 2-amino-4',4',6',9'-tetramethyl-2',5-dioxo-2',4',5,6,7,8-hexahydrospiro[chromene-4,1'-pyrrolo[3,2,1-ij]quinoline]-3-carboxylate?
The CAS number of ethyl 2-amino-4',4',6',9'-tetramethyl-2',5-dioxo-2',4',5,6,7,8-hexahydrospiro[chromene-4,1'-pyrrolo[3,2,1-ij]quinoline]-3-carboxylate is 896839-91-1.
What is the molecular formula of ethyl 2-amino-4',4',6',9'-tetramethyl-2',5-dioxo-2',4',5,6,7,8-hexahydrospiro[chromene-4,1'-pyrrolo[3,2,1-ij]quinoline]-3-carboxylate?
The molecular formula of ethyl 2-amino-4',4',6',9'-tetramethyl-2',5-dioxo-2',4',5,6,7,8-hexahydrospiro[chromene-4,1'-pyrrolo[3,2,1-ij]quinoline]-3-carboxylate is C26H28N2O5.
What is the molecular weight of ethyl 2-amino-4',4',6',9'-tetramethyl-2',5-dioxo-2',4',5,6,7,8-hexahydrospiro[chromene-4,1'-pyrrolo[3,2,1-ij]quinoline]-3-carboxylate?
The molecular weight of ethyl 2-amino-4',4',6',9'-tetramethyl-2',5-dioxo-2',4',5,6,7,8-hexahydrospiro[chromene-4,1'-pyrrolo[3,2,1-ij]quinoline]-3-carboxylate is 448.20 g/mol.
Where can I buy ethyl 2-amino-4',4',6',9'-tetramethyl-2',5-dioxo-2',4',5,6,7,8-hexahydrospiro[chromene-4,1'-pyrrolo[3,2,1-ij]quinoline]-3-carboxylate?
You can request a quote for ethyl 2-amino-4',4',6',9'-tetramethyl-2',5-dioxo-2',4',5,6,7,8-hexahydrospiro[chromene-4,1'-pyrrolo[3,2,1-ij]quinoline]-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 2-amino-4',4',6',9'-tetramethyl-2',5-dioxo-2',4',5,6,7,8-hexahydrospiro[chromene-4,1'-pyrrolo[3,2,1-ij]quinoline]-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 2-amino-4',4',6',9'-tetramethyl-2',5-dioxo-2',4',5,6,7,8-hexahydrospiro[chromene-4,1'-pyrrolo[3,2,1-ij]quinoline]-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.