![1-(3-((2,3-dimethylphenoxy)methyl)-4-methoxyphenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole structure](/static/products/404/404925-84-4.png)
1-(3-((2,3-dimethylphenoxy)methyl)-4-methoxyphenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
TL;DR: 1-(3-((2,3-dimethylphenoxy)methyl)-4-methoxyphenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole (CAS 404925-84-4) is a chemical compound with molecular formula C27H28N2O2 and molecular weight 412.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[3-[(2,3-dimethylphenoxy)methyl]-4-methoxyphenyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
Also Known As: 1-(3-((2,3-dimethylphenoxy)methyl)-4-methoxyphenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole, 1-{3-[(2,3-dimethylphenoxy)methyl]-4-methoxyphenyl}-2,3,4,9-tetrahydro-1H-beta-carboline, 1-[3-[(2,3-dimethylphenoxy)methyl]-4-methoxyphenyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
| Molecular Formula | C27H28N2O2 |
|---|---|
| Molecular Weight | 412.22 g/mol |
| LogP | 5.60744 |
| Topological Polar Surface Area | 46.28 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 412.2151 |
| Heavy Atoms | 31 |
| Complexity | 1241.4542 |
Chemical Identifiers
| CAS Number | 404925-84-4 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)OCC2=C(C=CC(=C2)C3C4=C(CCN3)C5=CC=CC=C5N4)OC)C |
Product Overview
1-(3-((2,3-dimethylphenoxy)methyl)-4-methoxyphenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole (CAS 404925-84-4), with molecular formula C27H28N2O2 and molecular weight 412.22 g/mol. IUPAC: 1-[3-[(2,3-dimethylphenoxy)methyl]-4-methoxyphenyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole.
Chemical Property Profile of 1-(3-((2,3-dimethylphenoxy)methyl)-4-methoxyphenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
Property Insights of 1-(3-((2,3-dimethylphenoxy)methyl)-4-methoxyphenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
The XLogP value of 5.60744 indicates that 1-(3-((2,3-dimethylphenoxy)methyl)-4-methoxyphenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.28 Ų, 1-(3-((2,3-dimethylphenoxy)methyl)-4-methoxyphenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3-((2,3-dimethylphenoxy)methyl)-4-methoxyphenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole has 2 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-(3-((2,3-dimethylphenoxy)methyl)-4-methoxyphenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole?
The CAS number of 1-(3-((2,3-dimethylphenoxy)methyl)-4-methoxyphenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole is 404925-84-4.
What is the molecular formula of 1-(3-((2,3-dimethylphenoxy)methyl)-4-methoxyphenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole?
The molecular formula of 1-(3-((2,3-dimethylphenoxy)methyl)-4-methoxyphenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole is C27H28N2O2.
What is the molecular weight of 1-(3-((2,3-dimethylphenoxy)methyl)-4-methoxyphenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole?
The molecular weight of 1-(3-((2,3-dimethylphenoxy)methyl)-4-methoxyphenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole is 412.22 g/mol.
Where can I buy 1-(3-((2,3-dimethylphenoxy)methyl)-4-methoxyphenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole?
You can request a quote for 1-(3-((2,3-dimethylphenoxy)methyl)-4-methoxyphenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3-((2,3-dimethylphenoxy)methyl)-4-methoxyphenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-((2,3-dimethylphenoxy)methyl)-4-methoxyphenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.