![8-Methoxy-1,2,3,4,5,6-hexahydroazepino[4,5-b]indole structure](/static/products/1591/15918-87-3.webp)
8-Methoxy-1,2,3,4,5,6-hexahydroazepino[4,5-b]indole
TL;DR: 8-Methoxy-1,2,3,4,5,6-hexahydroazepino[4,5-b]indole (CAS 15918-87-3) is a chemical compound with molecular formula C13H16N2O and molecular weight 216.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-methoxy-1,2,3,4,5,6-hexahydroazepino[4,5-b]indole
Also Known As: 8-methoxy-1,2,3,4,5,6-hexahydroazepino[4,5-b]indole, 1,2,3,4,5,6-Hexahydro-8-methoxyazepino[4,5-b]indole, 8-methoxy-1H,2H,3H,4H,5H,6H-azepino[4,5-b]indole
| Molecular Formula | C13H16N2O |
|---|---|
| Molecular Weight | 216.13 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 37.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 216.12627 |
| Heavy Atoms | 16 |
| Complexity | 246.0 |
Chemical Identifiers
| CAS Number | 15918-87-3 |
|---|---|
| SMILES | COC1=CC2=C(C=C1)C3=C(N2)CCNCC3 |
| InChIKey | KBOKHQHJZARQQA-UHFFFAOYSA-N |
Product Overview
8-Methoxy-1,2,3,4,5,6-hexahydroazepino[4,5-b]indole (CAS 15918-87-3), with molecular formula C13H16N2O and molecular weight 216.13 g/mol. IUPAC: 8-methoxy-1,2,3,4,5,6-hexahydroazepino[4,5-b]indole.
Chemical Property Profile of 8-Methoxy-1,2,3,4,5,6-hexahydroazepino[4,5-b]indole
Property Insights of 8-Methoxy-1,2,3,4,5,6-hexahydroazepino[4,5-b]indole
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-Methoxy-1,2,3,4,5,6-hexahydroazepino[4,5-b]indole. With a topological polar surface area (TPSA) of 37.1 Ų, 8-Methoxy-1,2,3,4,5,6-hexahydroazepino[4,5-b]indole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8-Methoxy-1,2,3,4,5,6-hexahydroazepino[4,5-b]indole has 2 hydrogen bond donor(s) and 2 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 8-Methoxy-1,2,3,4,5,6-hexahydroazepino[4,5-b]indole?
The CAS number of 8-Methoxy-1,2,3,4,5,6-hexahydroazepino[4,5-b]indole is 15918-87-3.
What is the molecular formula of 8-Methoxy-1,2,3,4,5,6-hexahydroazepino[4,5-b]indole?
The molecular formula of 8-Methoxy-1,2,3,4,5,6-hexahydroazepino[4,5-b]indole is C13H16N2O.
What is the molecular weight of 8-Methoxy-1,2,3,4,5,6-hexahydroazepino[4,5-b]indole?
The molecular weight of 8-Methoxy-1,2,3,4,5,6-hexahydroazepino[4,5-b]indole is 216.13 g/mol.
Where can I buy 8-Methoxy-1,2,3,4,5,6-hexahydroazepino[4,5-b]indole?
You can request a quote for 8-Methoxy-1,2,3,4,5,6-hexahydroazepino[4,5-b]indole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-Methoxy-1,2,3,4,5,6-hexahydroazepino[4,5-b]indole?
Yes, KEHONG BIO provides custom synthesis services for 8-Methoxy-1,2,3,4,5,6-hexahydroazepino[4,5-b]indole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.