6-methoxy-1-[4-methoxy-3-[(4-nitrophenoxy)methyl]phenyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
TL;DR: 6-methoxy-1-[4-methoxy-3-[(4-nitrophenoxy)methyl]phenyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole (CAS 404929-94-8) is a chemical compound with molecular formula C26H25N3O5 and molecular weight 459.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-methoxy-1-[4-methoxy-3-[(4-nitrophenoxy)methyl]phenyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
Also Known As: 6-methoxy-1-[4-methoxy-3-[(4-nitrophenoxy)methyl]phenyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole, 6-methoxy-1-(4-methoxy-3-((4-nitrophenoxy)methyl)phenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
| Molecular Formula | C26H25N3O5 |
|---|---|
| Molecular Weight | 459.18 g/mol |
| LogP | 4.9074 |
| Topological Polar Surface Area | 98.65 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 459.1794 |
| Heavy Atoms | 34 |
| Complexity | 1346.8125 |
Chemical Identifiers
| CAS Number | 404929-94-8 |
|---|---|
| SMILES | COC1=CC2=C(C=C1)NC3=C2CCNC3C4=CC(=C(C=C4)OC)COC5=CC=C(C=C5)[N+](=O)[O-] |
Product Overview
6-methoxy-1-[4-methoxy-3-[(4-nitrophenoxy)methyl]phenyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole (CAS 404929-94-8), with molecular formula C26H25N3O5 and molecular weight 459.18 g/mol. IUPAC: 6-methoxy-1-[4-methoxy-3-[(4-nitrophenoxy)methyl]phenyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole.
Chemical Property Profile of 6-methoxy-1-[4-methoxy-3-[(4-nitrophenoxy)methyl]phenyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
Property Insights of 6-methoxy-1-[4-methoxy-3-[(4-nitrophenoxy)methyl]phenyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
The XLogP value of 4.9074 indicates that 6-methoxy-1-[4-methoxy-3-[(4-nitrophenoxy)methyl]phenyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.65 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-methoxy-1-[4-methoxy-3-[(4-nitrophenoxy)methyl]phenyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole. Following Lipinski's Rule of Five, 6-methoxy-1-[4-methoxy-3-[(4-nitrophenoxy)methyl]phenyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole has 2 hydrogen bond donor(s) and 6 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 6-methoxy-1-[4-methoxy-3-[(4-nitrophenoxy)methyl]phenyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole?
The CAS number of 6-methoxy-1-[4-methoxy-3-[(4-nitrophenoxy)methyl]phenyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole is 404929-94-8.
What is the molecular formula of 6-methoxy-1-[4-methoxy-3-[(4-nitrophenoxy)methyl]phenyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole?
The molecular formula of 6-methoxy-1-[4-methoxy-3-[(4-nitrophenoxy)methyl]phenyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole is C26H25N3O5.
What is the molecular weight of 6-methoxy-1-[4-methoxy-3-[(4-nitrophenoxy)methyl]phenyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole?
The molecular weight of 6-methoxy-1-[4-methoxy-3-[(4-nitrophenoxy)methyl]phenyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole is 459.18 g/mol.
Where can I buy 6-methoxy-1-[4-methoxy-3-[(4-nitrophenoxy)methyl]phenyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole?
You can request a quote for 6-methoxy-1-[4-methoxy-3-[(4-nitrophenoxy)methyl]phenyl]-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 6-methoxy-1-[4-methoxy-3-[(4-nitrophenoxy)methyl]phenyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole?
Yes, KEHONG BIO provides custom synthesis services for 6-methoxy-1-[4-methoxy-3-[(4-nitrophenoxy)methyl]phenyl]-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.