6a-alpha-Aporphine, 1,2,9,10-tetramethoxy-, 6-oxide
TL;DR: 6a-alpha-Aporphine, 1,2,9,10-tetramethoxy-, 6-oxide (CAS 72498-23-8) is a chemical compound with molecular formula C21H25NO5 and molecular weight 371.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6aS)-1,2,9,10-tetramethoxy-6-methyl-6-oxido-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-6-ium
Also Known As: 1,2,9,10-Tetramethoxy-6a-alpha-aporphine 6-oxide, 6a-alpha-APORPHINE, 1,2,9,10-TETRAMETHOXY-, 6-OXIDE, -5,6,6a,7-Tetrahydro-1,2,9,10-tetramethoxy-6-methyl-4H-dibenzo[de,g]quinoline6-oxide, (6aS)-1,2,9,10-Tetramethoxy-6-methyl-6-oxo-5,6,6a,7-tetrahydro-4H-6lambda~5~-dibenzo[de,g]quinoline, (6aS)-5,6,6a,7-Tetrahydro-1,2,9,10-tetramethoxy-6-methyl-4H-dibenzo[de,g]quinoline 6-oxide
| Molecular Formula | C21H25NO5 |
|---|---|
| Molecular Weight | 371.17 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 55.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 371.17328 |
| Heavy Atoms | 27 |
| Complexity | 533.0 |
Chemical Identifiers
| CAS Number | 72498-23-8 |
|---|---|
| SMILES | C[N+]1(CCC2=CC(=C(C3=C2[C@@H]1CC4=CC(=C(C=C43)OC)OC)OC)OC)[O-] |
| InChIKey | MSASNZOEWLALSO-UEDXYCIISA-N |
Product Overview
6a-alpha-Aporphine, 1,2,9,10-tetramethoxy-, 6-oxide (CAS 72498-23-8), with molecular formula C21H25NO5 and molecular weight 371.17 g/mol. IUPAC: (6aS)-1,2,9,10-tetramethoxy-6-methyl-6-oxido-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-6-ium.
Chemical Property Profile of 6a-alpha-Aporphine, 1,2,9,10-tetramethoxy-, 6-oxide
Property Insights of 6a-alpha-Aporphine, 1,2,9,10-tetramethoxy-, 6-oxide
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6a-alpha-Aporphine, 1,2,9,10-tetramethoxy-, 6-oxide. With a topological polar surface area (TPSA) of 55.0 Ų, 6a-alpha-Aporphine, 1,2,9,10-tetramethoxy-, 6-oxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6a-alpha-Aporphine, 1,2,9,10-tetramethoxy-, 6-oxide has 0 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 6a-alpha-Aporphine, 1,2,9,10-tetramethoxy-, 6-oxide?
The CAS number of 6a-alpha-Aporphine, 1,2,9,10-tetramethoxy-, 6-oxide is 72498-23-8.
What is the molecular formula of 6a-alpha-Aporphine, 1,2,9,10-tetramethoxy-, 6-oxide?
The molecular formula of 6a-alpha-Aporphine, 1,2,9,10-tetramethoxy-, 6-oxide is C21H25NO5.
What is the molecular weight of 6a-alpha-Aporphine, 1,2,9,10-tetramethoxy-, 6-oxide?
The molecular weight of 6a-alpha-Aporphine, 1,2,9,10-tetramethoxy-, 6-oxide is 371.17 g/mol.
Where can I buy 6a-alpha-Aporphine, 1,2,9,10-tetramethoxy-, 6-oxide?
You can request a quote for 6a-alpha-Aporphine, 1,2,9,10-tetramethoxy-, 6-oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6a-alpha-Aporphine, 1,2,9,10-tetramethoxy-, 6-oxide?
Yes, KEHONG BIO provides custom synthesis services for 6a-alpha-Aporphine, 1,2,9,10-tetramethoxy-, 6-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.