Rogersine beta-N-oxide
TL;DR: Rogersine beta-N-oxide (CAS 100010-00-2) is a chemical compound with molecular formula C20H23NO5 and molecular weight 357.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6R,6aS)-1,2,10-trimethoxy-6-methyl-6-oxido-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-6-ium-9-ol
Also Known As: Rogersine beta-N-oxide, Lauroscholtzine beta-N-oxide, (+)-N-Methyllaurotetranine beta-N-oxide, 6R,6aS-N-Methyllaurotetanine Nbeta-oxide, J2.463.961D
| Molecular Formula | C20H23NO5 |
|---|---|
| Molecular Weight | 357.16 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 66.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 357.15762 |
| Heavy Atoms | 26 |
| Complexity | 518.0 |
Chemical Identifiers
| CAS Number | 100010-00-2 |
|---|---|
| SMILES | C[N@+]1(CCC2=CC(=C(C3=C2[C@@H]1CC4=CC(=C(C=C43)OC)O)OC)OC)[O-] |
| InChIKey | NBDQYITZRPEYEM-LHSJRXKWSA-N |
Product Overview
Rogersine beta-N-oxide (CAS 100010-00-2), with molecular formula C20H23NO5 and molecular weight 357.16 g/mol. IUPAC: (6R,6aS)-1,2,10-trimethoxy-6-methyl-6-oxido-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-6-ium-9-ol.
Chemical Property Profile of Rogersine beta-N-oxide
Property Insights of Rogersine beta-N-oxide
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Rogersine beta-N-oxide. The TPSA of 66.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Rogersine beta-N-oxide. Following Lipinski's Rule of Five, Rogersine beta-N-oxide has 1 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 Rogersine beta-N-oxide?
The CAS number of Rogersine beta-N-oxide is 100010-00-2.
What is the molecular formula of Rogersine beta-N-oxide?
The molecular formula of Rogersine beta-N-oxide is C20H23NO5.
What is the molecular weight of Rogersine beta-N-oxide?
The molecular weight of Rogersine beta-N-oxide is 357.16 g/mol.
Where can I buy Rogersine beta-N-oxide?
You can request a quote for Rogersine beta-N-oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Rogersine beta-N-oxide?
Yes, KEHONG BIO provides custom synthesis services for Rogersine beta-N-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.