1-(5-Benzyloxy-3-indolylmethyl)-6-benzyloxy-1,2,3,4-tetrahydro-(9H)-pyrido(3,4-b)indole HCl
TL;DR: 1-(5-Benzyloxy-3-indolylmethyl)-6-benzyloxy-1,2,3,4-tetrahydro-(9H)-pyrido(3,4-b)indole HCl (CAS 61326-58-7) is a chemical compound with molecular formula C34H32ClN3O2 and molecular weight 549.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-phenylmethoxy-1-[(5-phenylmethoxy-1H-indol-3-yl)methyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole;hydrochloride
Also Known As: 1-(5-Benzyloxy-3-indolylmethyl)-6-benzyloxy-1,2,3,4-tetrahydro-(9H)-pyrido(3,4-b)indole HCl, 1H-Pyrido(3,4-b)indole, 2,3,4,9-tetrahydro-6-(phenylmethoxy)-1-((5-(phenylmethoxy)-1H-indol-3-yl)methyl)-, monohydrochloride, 6-(Benzyloxy)-1-{[5-(benzyloxy)-1H-indol-3-yl]methyl}-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole--hydrogen chloride (1/1), 6-phenylmethoxy-1-[(5-phenylmethoxy-1H-indol-3-yl)methyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole hydrochloride, RefChem:240209
| Molecular Formula | C34H32ClN3O2 |
|---|---|
| Molecular Weight | 549.22 g/mol |
| LogP | 7.6585 |
| Topological Polar Surface Area | 62.07 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 549.2183 |
| Heavy Atoms | 40 |
| Complexity | 1726.6696 |
Chemical Identifiers
| CAS Number | 61326-58-7 |
|---|---|
| SMILES | C1CNC(C2=C1C3=C(N2)C=CC(=C3)OCC4=CC=CC=C4)CC5=CNC6=C5C=C(C=C6)OCC7=CC=CC=C7.Cl |
Product Overview
1-(5-Benzyloxy-3-indolylmethyl)-6-benzyloxy-1,2,3,4-tetrahydro-(9H)-pyrido(3,4-b)indole HCl (CAS 61326-58-7), with molecular formula C34H32ClN3O2 and molecular weight 549.22 g/mol. IUPAC: 6-phenylmethoxy-1-[(5-phenylmethoxy-1H-indol-3-yl)methyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole;hydrochloride.
Chemical Property Profile of 1-(5-Benzyloxy-3-indolylmethyl)-6-benzyloxy-1,2,3,4-tetrahydro-(9H)-pyrido(3,4-b)indole HCl
Property Insights of 1-(5-Benzyloxy-3-indolylmethyl)-6-benzyloxy-1,2,3,4-tetrahydro-(9H)-pyrido(3,4-b)indole HCl
The XLogP value of 7.6585 indicates that 1-(5-Benzyloxy-3-indolylmethyl)-6-benzyloxy-1,2,3,4-tetrahydro-(9H)-pyrido(3,4-b)indole HCl is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.07 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(5-Benzyloxy-3-indolylmethyl)-6-benzyloxy-1,2,3,4-tetrahydro-(9H)-pyrido(3,4-b)indole HCl. Following Lipinski's Rule of Five, 1-(5-Benzyloxy-3-indolylmethyl)-6-benzyloxy-1,2,3,4-tetrahydro-(9H)-pyrido(3,4-b)indole HCl has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(5-Benzyloxy-3-indolylmethyl)-6-benzyloxy-1,2,3,4-tetrahydro-(9H)-pyrido(3,4-b)indole HCl?
The CAS number of 1-(5-Benzyloxy-3-indolylmethyl)-6-benzyloxy-1,2,3,4-tetrahydro-(9H)-pyrido(3,4-b)indole HCl is 61326-58-7.
What is the molecular formula of 1-(5-Benzyloxy-3-indolylmethyl)-6-benzyloxy-1,2,3,4-tetrahydro-(9H)-pyrido(3,4-b)indole HCl?
The molecular formula of 1-(5-Benzyloxy-3-indolylmethyl)-6-benzyloxy-1,2,3,4-tetrahydro-(9H)-pyrido(3,4-b)indole HCl is C34H32ClN3O2.
What is the molecular weight of 1-(5-Benzyloxy-3-indolylmethyl)-6-benzyloxy-1,2,3,4-tetrahydro-(9H)-pyrido(3,4-b)indole HCl?
The molecular weight of 1-(5-Benzyloxy-3-indolylmethyl)-6-benzyloxy-1,2,3,4-tetrahydro-(9H)-pyrido(3,4-b)indole HCl is 549.22 g/mol.
Where can I buy 1-(5-Benzyloxy-3-indolylmethyl)-6-benzyloxy-1,2,3,4-tetrahydro-(9H)-pyrido(3,4-b)indole HCl?
You can request a quote for 1-(5-Benzyloxy-3-indolylmethyl)-6-benzyloxy-1,2,3,4-tetrahydro-(9H)-pyrido(3,4-b)indole HCl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(5-Benzyloxy-3-indolylmethyl)-6-benzyloxy-1,2,3,4-tetrahydro-(9H)-pyrido(3,4-b)indole HCl?
Yes, KEHONG BIO provides custom synthesis services for 1-(5-Benzyloxy-3-indolylmethyl)-6-benzyloxy-1,2,3,4-tetrahydro-(9H)-pyrido(3,4-b)indole HCl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.