Pyrazino(1',2':1,6)pyrido(3,4-b)indole, 1,2,3,4,6,7,12,12a-octahydro-2-(2-((4-fluorophenyl)phenylmethoxy)ethyl)-
TL;DR: Pyrazino(1',2':1,6)pyrido(3,4-b)indole, 1,2,3,4,6,7,12,12a-octahydro-2-(2-((4-fluorophenyl)phenylmethoxy)ethyl)- (CAS 72593-41-0) is a chemical compound with molecular formula C29H30FN3O and molecular weight 455.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[2-[(4-fluorophenyl)-phenylmethoxy]ethyl]-3,6,17-triazatetracyclo[8.7.0.03,8.011,16]heptadeca-1(10),11,13,15-tetraene
Also Known As: Pyrazino(1',2':1,6)pyrido(3,4-b)indole, 1,2,3,4,6,7,12,12a-octahydro-2-(2-((4-fluorophenyl)phenylmethoxy)ethyl)-, 2-{2-[(4-Fluorophenyl)(phenyl)methoxy]ethyl}-1,2,3,4,6,7,12,12a-octahydropyrazino[1',2':1,6]pyrido[3,4-b]indole, BRN 4599380, RefChem:375967
| Molecular Formula | C29H30FN3O |
|---|---|
| Molecular Weight | 455.24 g/mol |
| LogP | 5.1555 |
| Topological Polar Surface Area | 31.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 455.2373 |
| Heavy Atoms | 34 |
| Complexity | 1253.6171 |
Chemical Identifiers
| CAS Number | 72593-41-0 |
|---|---|
| SMILES | C1CN2CC3=C(CC2CN1CCOC(C4=CC=CC=C4)C5=CC=C(C=C5)F)C6=CC=CC=C6N3 |
Product Overview
Pyrazino(1',2':1,6)pyrido(3,4-b)indole, 1,2,3,4,6,7,12,12a-octahydro-2-(2-((4-fluorophenyl)phenylmethoxy)ethyl)- (CAS 72593-41-0), with molecular formula C29H30FN3O and molecular weight 455.24 g/mol. IUPAC: 6-[2-[(4-fluorophenyl)-phenylmethoxy]ethyl]-3,6,17-triazatetracyclo[8.7.0.03,8.011,16]heptadeca-1(10),11,13,15-tetraene.
Chemical Property Profile of Pyrazino(1',2':1,6)pyrido(3,4-b)indole, 1,2,3,4,6,7,12,12a-octahydro-2-(2-((4-fluorophenyl)phenylmethoxy)ethyl)-
Property Insights of Pyrazino(1',2':1,6)pyrido(3,4-b)indole, 1,2,3,4,6,7,12,12a-octahydro-2-(2-((4-fluorophenyl)phenylmethoxy)ethyl)-
The XLogP value of 5.1555 indicates that Pyrazino(1',2':1,6)pyrido(3,4-b)indole, 1,2,3,4,6,7,12,12a-octahydro-2-(2-((4-fluorophenyl)phenylmethoxy)ethyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 31.5 Ų, Pyrazino(1',2':1,6)pyrido(3,4-b)indole, 1,2,3,4,6,7,12,12a-octahydro-2-(2-((4-fluorophenyl)phenylmethoxy)ethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyrazino(1',2':1,6)pyrido(3,4-b)indole, 1,2,3,4,6,7,12,12a-octahydro-2-(2-((4-fluorophenyl)phenylmethoxy)ethyl)- has 1 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 Pyrazino(1',2':1,6)pyrido(3,4-b)indole, 1,2,3,4,6,7,12,12a-octahydro-2-(2-((4-fluorophenyl)phenylmethoxy)ethyl)-?
The CAS number of Pyrazino(1',2':1,6)pyrido(3,4-b)indole, 1,2,3,4,6,7,12,12a-octahydro-2-(2-((4-fluorophenyl)phenylmethoxy)ethyl)- is 72593-41-0.
What is the molecular formula of Pyrazino(1',2':1,6)pyrido(3,4-b)indole, 1,2,3,4,6,7,12,12a-octahydro-2-(2-((4-fluorophenyl)phenylmethoxy)ethyl)-?
The molecular formula of Pyrazino(1',2':1,6)pyrido(3,4-b)indole, 1,2,3,4,6,7,12,12a-octahydro-2-(2-((4-fluorophenyl)phenylmethoxy)ethyl)- is C29H30FN3O.
What is the molecular weight of Pyrazino(1',2':1,6)pyrido(3,4-b)indole, 1,2,3,4,6,7,12,12a-octahydro-2-(2-((4-fluorophenyl)phenylmethoxy)ethyl)-?
The molecular weight of Pyrazino(1',2':1,6)pyrido(3,4-b)indole, 1,2,3,4,6,7,12,12a-octahydro-2-(2-((4-fluorophenyl)phenylmethoxy)ethyl)- is 455.24 g/mol.
Where can I buy Pyrazino(1',2':1,6)pyrido(3,4-b)indole, 1,2,3,4,6,7,12,12a-octahydro-2-(2-((4-fluorophenyl)phenylmethoxy)ethyl)-?
You can request a quote for Pyrazino(1',2':1,6)pyrido(3,4-b)indole, 1,2,3,4,6,7,12,12a-octahydro-2-(2-((4-fluorophenyl)phenylmethoxy)ethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrazino(1',2':1,6)pyrido(3,4-b)indole, 1,2,3,4,6,7,12,12a-octahydro-2-(2-((4-fluorophenyl)phenylmethoxy)ethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Pyrazino(1',2':1,6)pyrido(3,4-b)indole, 1,2,3,4,6,7,12,12a-octahydro-2-(2-((4-fluorophenyl)phenylmethoxy)ethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.