Dehydrostephalagine
TL;DR: Dehydrostephalagine (CAS 107882-28-0) is a chemical compound with molecular formula C19H17NO3 and molecular weight 307.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-methoxy-11-methyl-3,5-dioxa-11-azapentacyclo[10.7.1.02,6.08,20.014,19]icosa-1,6,8(20),12,14,16,18-heptaene
Also Known As: Dehydrostephalagine, 5H-Benzo(g)-1,3-benzodioxolo(6,5,4-de)quinoline, 6,7-dihydro-4-methoxy-7-methyl-, 4-Methoxy-7-methyl-6,7-dihydro-2H,5H-[1,3]benzodioxolo[6,5,4-de]benzo[g]quinoline, 7-methoxy-11-methyl-3,5-dioxa-11-azapentacyclo(10.7.1.02,6.08,20.014,19)icosa-1,6,8(20),12,14,16,18-heptaene, 7-methoxy-11-methyl-3,5-dioxa-11-azapentacyclo[10.7.1.02,6.08,20.014,19]icosa-1,6,8(20),12,14,16,18-heptaene
| Molecular Formula | C19H17NO3 |
|---|---|
| Molecular Weight | 307.12 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 30.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 307.12085 |
| Heavy Atoms | 23 |
| Complexity | 458.0 |
Chemical Identifiers
| CAS Number | 107882-28-0 |
|---|---|
| SMILES | CN1CCC2=C3C1=CC4=CC=CC=C4C3=C5C(=C2OC)OCO5 |
| InChIKey | VQOWFNUMBHRHJU-UHFFFAOYSA-N |
Product Overview
Dehydrostephalagine (CAS 107882-28-0), with molecular formula C19H17NO3 and molecular weight 307.12 g/mol. IUPAC: 7-methoxy-11-methyl-3,5-dioxa-11-azapentacyclo[10.7.1.02,6.08,20.014,19]icosa-1,6,8(20),12,14,16,18-heptaene.
Chemical Property Profile of Dehydrostephalagine
Property Insights of Dehydrostephalagine
The XLogP value of 4.4 indicates that Dehydrostephalagine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 30.9 Ų, Dehydrostephalagine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dehydrostephalagine has 0 hydrogen bond donor(s) and 4 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 Dehydrostephalagine?
The CAS number of Dehydrostephalagine is 107882-28-0.
What is the molecular formula of Dehydrostephalagine?
The molecular formula of Dehydrostephalagine is C19H17NO3.
What is the molecular weight of Dehydrostephalagine?
The molecular weight of Dehydrostephalagine is 307.12 g/mol.
Where can I buy Dehydrostephalagine?
You can request a quote for Dehydrostephalagine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dehydrostephalagine?
Yes, KEHONG BIO provides custom synthesis services for Dehydrostephalagine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.