1-(4-Chlorophenyl)-6-methoxy-1,2,3,4-tetrahydroisoquinoline
TL;DR: 1-(4-Chlorophenyl)-6-methoxy-1,2,3,4-tetrahydroisoquinoline (CAS 596083-57-7) is a chemical compound with molecular formula C16H16ClNO and molecular weight 273.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chlorophenyl)-6-methoxy-1,2,3,4-tetrahydroisoquinoline
Also Known As: 1-(4-chlorophenyl)-6-methoxy-1,2,3,4-tetrahydroisoquinoline
| Molecular Formula | C16H16ClNO |
|---|---|
| Molecular Weight | 273.09 g/mol |
| LogP | 3.5837 |
| Topological Polar Surface Area | 21.26 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 273.09204 |
| Heavy Atoms | 19 |
| Complexity | 579.80286 |
Chemical Identifiers
| CAS Number | 596083-57-7 |
|---|---|
| SMILES | COC1=CC2=C(C=C1)C(NCC2)C3=CC=C(C=C3)Cl |
Product Overview
1-(4-Chlorophenyl)-6-methoxy-1,2,3,4-tetrahydroisoquinoline (CAS 596083-57-7), with molecular formula C16H16ClNO and molecular weight 273.09 g/mol. IUPAC: 1-(4-chlorophenyl)-6-methoxy-1,2,3,4-tetrahydroisoquinoline.
Chemical Property Profile of 1-(4-Chlorophenyl)-6-methoxy-1,2,3,4-tetrahydroisoquinoline
Property Insights of 1-(4-Chlorophenyl)-6-methoxy-1,2,3,4-tetrahydroisoquinoline
The XLogP value of 3.5837 indicates that 1-(4-Chlorophenyl)-6-methoxy-1,2,3,4-tetrahydroisoquinoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 21.26 Ų, 1-(4-Chlorophenyl)-6-methoxy-1,2,3,4-tetrahydroisoquinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Chlorophenyl)-6-methoxy-1,2,3,4-tetrahydroisoquinoline has 1 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 1-(4-Chlorophenyl)-6-methoxy-1,2,3,4-tetrahydroisoquinoline?
The CAS number of 1-(4-Chlorophenyl)-6-methoxy-1,2,3,4-tetrahydroisoquinoline is 596083-57-7.
What is the molecular formula of 1-(4-Chlorophenyl)-6-methoxy-1,2,3,4-tetrahydroisoquinoline?
The molecular formula of 1-(4-Chlorophenyl)-6-methoxy-1,2,3,4-tetrahydroisoquinoline is C16H16ClNO.
What is the molecular weight of 1-(4-Chlorophenyl)-6-methoxy-1,2,3,4-tetrahydroisoquinoline?
The molecular weight of 1-(4-Chlorophenyl)-6-methoxy-1,2,3,4-tetrahydroisoquinoline is 273.09 g/mol.
Where can I buy 1-(4-Chlorophenyl)-6-methoxy-1,2,3,4-tetrahydroisoquinoline?
You can request a quote for 1-(4-Chlorophenyl)-6-methoxy-1,2,3,4-tetrahydroisoquinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Chlorophenyl)-6-methoxy-1,2,3,4-tetrahydroisoquinoline?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Chlorophenyl)-6-methoxy-1,2,3,4-tetrahydroisoquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.