Azepino(4,5-b)indole, 1,2,3,4,5,6-hexahydro-9-methoxy-, monohydrochloride
TL;DR: Azepino(4,5-b)indole, 1,2,3,4,5,6-hexahydro-9-methoxy-, monohydrochloride (CAS 15918-69-1) is a chemical compound with molecular formula C13H17ClN2O and molecular weight 252.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-methoxy-1,2,3,4,5,6-hexahydroazepino[4,5-b]indol-6-ium chloride
Also Known As: 1,2,3,4,5,6-Hexahydro-9-methoxy-azepino(4,5-b)indole hydrochloride, 9-methoxy-1,2,3,4,5,6-hexahydroazepino[4,5-b]indol-6-ium chloride, AZEPINO(4,5-b)INDOLE, 1,2,3,4,5,6-HEXAHYDRO-9-METHOXY-, MONOHYDROCHLORIDE, RefChem:320301
| Molecular Formula | C13H17ClN2O |
|---|---|
| Molecular Weight | 252.10 g/mol |
| LogP | -2.0 |
| Topological Polar Surface Area | 37.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 252.10294 |
| Heavy Atoms | 17 |
| Complexity | 300.0 |
Chemical Identifiers
| CAS Number | 15918-69-1 |
|---|---|
| SMILES | COC1=CC2=C(C=C1)[NH2+]C3=C2CCNCC3.[Cl-] |
| InChIKey | WDQOOVYERRHQNS-UHFFFAOYSA-N |
Product Overview
Azepino(4,5-b)indole, 1,2,3,4,5,6-hexahydro-9-methoxy-, monohydrochloride (CAS 15918-69-1), with molecular formula C13H17ClN2O and molecular weight 252.10 g/mol. IUPAC: 9-methoxy-1,2,3,4,5,6-hexahydroazepino[4,5-b]indol-6-ium chloride.
Chemical Property Profile of Azepino(4,5-b)indole, 1,2,3,4,5,6-hexahydro-9-methoxy-, monohydrochloride
Property Insights of Azepino(4,5-b)indole, 1,2,3,4,5,6-hexahydro-9-methoxy-, monohydrochloride
The XLogP value of -2.0 indicates that Azepino(4,5-b)indole, 1,2,3,4,5,6-hexahydro-9-methoxy-, monohydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 37.9 Ų, Azepino(4,5-b)indole, 1,2,3,4,5,6-hexahydro-9-methoxy-, monohydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Azepino(4,5-b)indole, 1,2,3,4,5,6-hexahydro-9-methoxy-, monohydrochloride has 2 hydrogen bond donor(s) and 3 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 Azepino(4,5-b)indole, 1,2,3,4,5,6-hexahydro-9-methoxy-, monohydrochloride?
The CAS number of Azepino(4,5-b)indole, 1,2,3,4,5,6-hexahydro-9-methoxy-, monohydrochloride is 15918-69-1.
What is the molecular formula of Azepino(4,5-b)indole, 1,2,3,4,5,6-hexahydro-9-methoxy-, monohydrochloride?
The molecular formula of Azepino(4,5-b)indole, 1,2,3,4,5,6-hexahydro-9-methoxy-, monohydrochloride is C13H17ClN2O.
What is the molecular weight of Azepino(4,5-b)indole, 1,2,3,4,5,6-hexahydro-9-methoxy-, monohydrochloride?
The molecular weight of Azepino(4,5-b)indole, 1,2,3,4,5,6-hexahydro-9-methoxy-, monohydrochloride is 252.10 g/mol.
Where can I buy Azepino(4,5-b)indole, 1,2,3,4,5,6-hexahydro-9-methoxy-, monohydrochloride?
You can request a quote for Azepino(4,5-b)indole, 1,2,3,4,5,6-hexahydro-9-methoxy-, monohydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Azepino(4,5-b)indole, 1,2,3,4,5,6-hexahydro-9-methoxy-, monohydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Azepino(4,5-b)indole, 1,2,3,4,5,6-hexahydro-9-methoxy-, monohydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.