Azepino(4,5-b)indole, 6-benzyl-1,2,3,4,5,6-hexahydro-, monohydrochloride
TL;DR: Azepino(4,5-b)indole, 6-benzyl-1,2,3,4,5,6-hexahydro-, monohydrochloride (CAS 7345-43-9) is a chemical compound with molecular formula C19H21ClN2 and molecular weight 312.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-benzyl-1,2,3,4,5,6-hexahydroazepino[4,5-b]indol-6-ium chloride
Also Known As: 6-Benzyl-1,2,3,4,5,6-hexahydro-azepino(4,5-b)indole hydrochloride, Azepino(4,5-b)indole, 1,2,3,4,5,6-hexahydro-6-benzyl-, hydrochloride, AZEPINO(4,5-b)INDOLE, 6-BENZYL-1,2,3,4,5,6-HEXAHYDRO-, MONOHYDROCHLORIDE, 6-benzyl-1,2,3,4,5,6-hexahydroazepino[4,5-b]indol-6-ium chloride, RefChem:1077400
| Molecular Formula | C19H21ClN2 |
|---|---|
| Molecular Weight | 312.14 g/mol |
| LogP | -0.48 |
| Topological Polar Surface Area | 16.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 312.1393 |
| Heavy Atoms | 22 |
| Complexity | 394.0 |
Chemical Identifiers
| CAS Number | 7345-43-9 |
|---|---|
| SMILES | C1CNCCC2=C1C3=CC=CC=C3[NH+]2CC4=CC=CC=C4.[Cl-] |
| InChIKey | WHPHIFMPUDPVGE-UHFFFAOYSA-N |
Product Overview
Azepino(4,5-b)indole, 6-benzyl-1,2,3,4,5,6-hexahydro-, monohydrochloride (CAS 7345-43-9), with molecular formula C19H21ClN2 and molecular weight 312.14 g/mol. IUPAC: 6-benzyl-1,2,3,4,5,6-hexahydroazepino[4,5-b]indol-6-ium chloride.
Chemical Property Profile of Azepino(4,5-b)indole, 6-benzyl-1,2,3,4,5,6-hexahydro-, monohydrochloride
Property Insights of Azepino(4,5-b)indole, 6-benzyl-1,2,3,4,5,6-hexahydro-, monohydrochloride
The XLogP value of -0.48 indicates that Azepino(4,5-b)indole, 6-benzyl-1,2,3,4,5,6-hexahydro-, monohydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 16.5 Ų, Azepino(4,5-b)indole, 6-benzyl-1,2,3,4,5,6-hexahydro-, monohydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Azepino(4,5-b)indole, 6-benzyl-1,2,3,4,5,6-hexahydro-, monohydrochloride 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 Azepino(4,5-b)indole, 6-benzyl-1,2,3,4,5,6-hexahydro-, monohydrochloride?
The CAS number of Azepino(4,5-b)indole, 6-benzyl-1,2,3,4,5,6-hexahydro-, monohydrochloride is 7345-43-9.
What is the molecular formula of Azepino(4,5-b)indole, 6-benzyl-1,2,3,4,5,6-hexahydro-, monohydrochloride?
The molecular formula of Azepino(4,5-b)indole, 6-benzyl-1,2,3,4,5,6-hexahydro-, monohydrochloride is C19H21ClN2.
What is the molecular weight of Azepino(4,5-b)indole, 6-benzyl-1,2,3,4,5,6-hexahydro-, monohydrochloride?
The molecular weight of Azepino(4,5-b)indole, 6-benzyl-1,2,3,4,5,6-hexahydro-, monohydrochloride is 312.14 g/mol.
Where can I buy Azepino(4,5-b)indole, 6-benzyl-1,2,3,4,5,6-hexahydro-, monohydrochloride?
You can request a quote for Azepino(4,5-b)indole, 6-benzyl-1,2,3,4,5,6-hexahydro-, 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, 6-benzyl-1,2,3,4,5,6-hexahydro-, monohydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Azepino(4,5-b)indole, 6-benzyl-1,2,3,4,5,6-hexahydro-, monohydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.