1,2,9-Trimethoxyoxoaporphine
TL;DR: 1,2,9-Trimethoxyoxoaporphine (CAS 70403-81-5) is a chemical compound with molecular formula C19H15NO4 and molecular weight 321.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,15,16-trimethoxy-10-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-8-one
Also Known As: 1,2,9-Trimethoxyoxoaporphine, 1,2,9-Trimethoxy-7-oxoaporphine, Poly(5-methoxyuridylic) acid, KST-1B8138, 1,2,9-trimethoxy-7h-dibenzo[de,g]quinolin-7-one
| Molecular Formula | C19H15NO4 |
|---|---|
| Molecular Weight | 321.10 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 57.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 321.1001 |
| Heavy Atoms | 24 |
| Complexity | 484.0 |
Chemical Identifiers
| CAS Number | 70403-81-5 |
|---|---|
| SMILES | COC1=CC2=C(C=C1)C3=C4C(=CC(=C3OC)OC)C=CN=C4C2=O |
| InChIKey | HGJOQONKWSVYMB-UHFFFAOYSA-N |
Product Overview
1,2,9-Trimethoxyoxoaporphine (CAS 70403-81-5), with molecular formula C19H15NO4 and molecular weight 321.10 g/mol. IUPAC: 5,15,16-trimethoxy-10-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-8-one.
Chemical Property Profile of 1,2,9-Trimethoxyoxoaporphine
Property Insights of 1,2,9-Trimethoxyoxoaporphine
The XLogP value of 3.5 indicates that 1,2,9-Trimethoxyoxoaporphine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.7 Ų, 1,2,9-Trimethoxyoxoaporphine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2,9-Trimethoxyoxoaporphine 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 1,2,9-Trimethoxyoxoaporphine?
The CAS number of 1,2,9-Trimethoxyoxoaporphine is 70403-81-5.
What is the molecular formula of 1,2,9-Trimethoxyoxoaporphine?
The molecular formula of 1,2,9-Trimethoxyoxoaporphine is C19H15NO4.
What is the molecular weight of 1,2,9-Trimethoxyoxoaporphine?
The molecular weight of 1,2,9-Trimethoxyoxoaporphine is 321.10 g/mol.
Where can I buy 1,2,9-Trimethoxyoxoaporphine?
You can request a quote for 1,2,9-Trimethoxyoxoaporphine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2,9-Trimethoxyoxoaporphine?
Yes, KEHONG BIO provides custom synthesis services for 1,2,9-Trimethoxyoxoaporphine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.