![2-amino-7-hydroxy-4',4',6',8',9'-pentamethyl-2'-oxo-4'H-spiro[chromene-4,1'-pyrrolo[3,2,1-ij]quinoline]-3-carbonitrile structure](/static/products/832/832687-99-7.png)
2-amino-7-hydroxy-4',4',6',8',9'-pentamethyl-2'-oxo-4'H-spiro[chromene-4,1'-pyrrolo[3,2,1-ij]quinoline]-3-carbonitrile
TL;DR: 2-amino-7-hydroxy-4',4',6',8',9'-pentamethyl-2'-oxo-4'H-spiro[chromene-4,1'-pyrrolo[3,2,1-ij]quinoline]-3-carbonitrile (CAS 832687-99-7) is a chemical compound with molecular formula C25H23N3O3 and molecular weight 413.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2'-amino-7'-hydroxy-5,6,9,11,11-pentamethyl-2-oxospiro[1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12),9-tetraene-3,4'-chromene]-3'-carbonitrile
Also Known As: 2-amino-7-hydroxy-4',4',6',8',9'-pentamethyl-2'-oxo-4'H-spiro[chromene-4,1'-pyrrolo[3,2,1-ij]quinoline]-3-carbonitrile, AO-022/43239907, 2-amino-7-hydroxy-4',4',6',8',9'-pentamethyl-2'-oxo-2',4'-dihydrospiro[chromene-4,1'-pyrrolo[3,2,1-ij]quinoline]-3-carbonitrile, 2'-Amino-7'-hydroxy-5,6,9,11,11-pentamethyl-2-oxospiro[1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12),9-tetraene-3,4'-chromene]-3'-carbonitrile, 2-amino-7-hydroxy-4',4',6',8',9'-pentamethyl-2'-oxospiro(chromene-4,1'-pyrrolo[3,2,1-ij]quinoline)-3-carbonitrile
| Molecular Formula | C25H23N3O3 |
|---|---|
| Molecular Weight | 413.17 g/mol |
| LogP | 3.92352 |
| Topological Polar Surface Area | 99.58 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 413.17395 |
| Heavy Atoms | 31 |
| Complexity | 1326.4982 |
Chemical Identifiers
| CAS Number | 832687-99-7 |
|---|---|
| SMILES | CC1=CC2=C3C(=C1C)C4(C5=C(C=C(C=C5)O)OC(=C4C#N)N)C(=O)N3C(C=C2C)(C)C |
Product Overview
2-amino-7-hydroxy-4',4',6',8',9'-pentamethyl-2'-oxo-4'H-spiro[chromene-4,1'-pyrrolo[3,2,1-ij]quinoline]-3-carbonitrile (CAS 832687-99-7), with molecular formula C25H23N3O3 and molecular weight 413.17 g/mol. IUPAC: 2'-amino-7'-hydroxy-5,6,9,11,11-pentamethyl-2-oxospiro[1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12),9-tetraene-3,4'-chromene]-3'-carbonitrile.
Chemical Property Profile of 2-amino-7-hydroxy-4',4',6',8',9'-pentamethyl-2'-oxo-4'H-spiro[chromene-4,1'-pyrrolo[3,2,1-ij]quinoline]-3-carbonitrile
Property Insights of 2-amino-7-hydroxy-4',4',6',8',9'-pentamethyl-2'-oxo-4'H-spiro[chromene-4,1'-pyrrolo[3,2,1-ij]quinoline]-3-carbonitrile
The XLogP value of 3.92352 indicates that 2-amino-7-hydroxy-4',4',6',8',9'-pentamethyl-2'-oxo-4'H-spiro[chromene-4,1'-pyrrolo[3,2,1-ij]quinoline]-3-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.58 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-amino-7-hydroxy-4',4',6',8',9'-pentamethyl-2'-oxo-4'H-spiro[chromene-4,1'-pyrrolo[3,2,1-ij]quinoline]-3-carbonitrile. Following Lipinski's Rule of Five, 2-amino-7-hydroxy-4',4',6',8',9'-pentamethyl-2'-oxo-4'H-spiro[chromene-4,1'-pyrrolo[3,2,1-ij]quinoline]-3-carbonitrile has 2 hydrogen bond donor(s) and 5 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 2-amino-7-hydroxy-4',4',6',8',9'-pentamethyl-2'-oxo-4'H-spiro[chromene-4,1'-pyrrolo[3,2,1-ij]quinoline]-3-carbonitrile?
The CAS number of 2-amino-7-hydroxy-4',4',6',8',9'-pentamethyl-2'-oxo-4'H-spiro[chromene-4,1'-pyrrolo[3,2,1-ij]quinoline]-3-carbonitrile is 832687-99-7.
What is the molecular formula of 2-amino-7-hydroxy-4',4',6',8',9'-pentamethyl-2'-oxo-4'H-spiro[chromene-4,1'-pyrrolo[3,2,1-ij]quinoline]-3-carbonitrile?
The molecular formula of 2-amino-7-hydroxy-4',4',6',8',9'-pentamethyl-2'-oxo-4'H-spiro[chromene-4,1'-pyrrolo[3,2,1-ij]quinoline]-3-carbonitrile is C25H23N3O3.
What is the molecular weight of 2-amino-7-hydroxy-4',4',6',8',9'-pentamethyl-2'-oxo-4'H-spiro[chromene-4,1'-pyrrolo[3,2,1-ij]quinoline]-3-carbonitrile?
The molecular weight of 2-amino-7-hydroxy-4',4',6',8',9'-pentamethyl-2'-oxo-4'H-spiro[chromene-4,1'-pyrrolo[3,2,1-ij]quinoline]-3-carbonitrile is 413.17 g/mol.
Where can I buy 2-amino-7-hydroxy-4',4',6',8',9'-pentamethyl-2'-oxo-4'H-spiro[chromene-4,1'-pyrrolo[3,2,1-ij]quinoline]-3-carbonitrile?
You can request a quote for 2-amino-7-hydroxy-4',4',6',8',9'-pentamethyl-2'-oxo-4'H-spiro[chromene-4,1'-pyrrolo[3,2,1-ij]quinoline]-3-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-amino-7-hydroxy-4',4',6',8',9'-pentamethyl-2'-oxo-4'H-spiro[chromene-4,1'-pyrrolo[3,2,1-ij]quinoline]-3-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-amino-7-hydroxy-4',4',6',8',9'-pentamethyl-2'-oxo-4'H-spiro[chromene-4,1'-pyrrolo[3,2,1-ij]quinoline]-3-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.