4-Chloro-n-methyl-2-(1,2,3,4-tetrahydroisoquinolin-1-yl)aniline
TL;DR: 4-Chloro-n-methyl-2-(1,2,3,4-tetrahydroisoquinolin-1-yl)aniline (CAS 23495-28-5) is a chemical compound with molecular formula C16H17ClN2 and molecular weight 272.10803 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-chloro-N-methyl-2-(1,2,3,4-tetrahydroisoquinolin-1-yl)aniline
Also Known As: 4-chloro-n-methyl-2-(1,2,3,4-tetrahydroisoquinolin-1-yl)aniline, dl-1-(5-chloro-2-1,2,3,4-tetrahydroisoquinoline, DL-1-(5-chloro-2- -1,2,3,4-tetrahydroisoquinoline, DL-1-(5-Chloro-2-(methylamino)phenyl)-1,2,3,4-tetrahydroisoquinoline, 1-(2-Methylamino-5-chlorphenyl)-1,2,3,4-tetrahydro-isochinolin
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C16H17ClN2 |
| Molecular Weight | 272.10803 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 24.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 272.10803 Da |
| Heavy Atoms | 19 |
| Complexity | 296.0 |
| SMILES | CNC1=C(C=C(C=C1)Cl)C2C3=CC=CC=C3CCN2 |
| InChIKey | XRUIERQCHYNNEP-UHFFFAOYSA-N |
Chemical Property Profile of 4-Chloro-n-methyl-2-(1,2,3,4-tetrahydroisoquinolin-1-yl)aniline
Property Insights of 4-Chloro-n-methyl-2-(1,2,3,4-tetrahydroisoquinolin-1-yl)aniline
The XLogP value of 3.6 indicates that 4-Chloro-n-methyl-2-(1,2,3,4-tetrahydroisoquinolin-1-yl)aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 24.1 Ų, 4-Chloro-n-methyl-2-(1,2,3,4-tetrahydroisoquinolin-1-yl)aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Chloro-n-methyl-2-(1,2,3,4-tetrahydroisoquinolin-1-yl)aniline has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-Chloro-n-methyl-2-(1,2,3,4-tetrahydroisoquinolin-1-yl)aniline?
The CAS number of 4-Chloro-n-methyl-2-(1,2,3,4-tetrahydroisoquinolin-1-yl)aniline is 23495-28-5.
What is the molecular formula of 4-Chloro-n-methyl-2-(1,2,3,4-tetrahydroisoquinolin-1-yl)aniline?
The molecular formula of 4-Chloro-n-methyl-2-(1,2,3,4-tetrahydroisoquinolin-1-yl)aniline is C16H17ClN2.
What is the molecular weight of 4-Chloro-n-methyl-2-(1,2,3,4-tetrahydroisoquinolin-1-yl)aniline?
The molecular weight of 4-Chloro-n-methyl-2-(1,2,3,4-tetrahydroisoquinolin-1-yl)aniline is 272.10803 g/mol.
Where can I buy 4-Chloro-n-methyl-2-(1,2,3,4-tetrahydroisoquinolin-1-yl)aniline?
You can request a quote for 4-Chloro-n-methyl-2-(1,2,3,4-tetrahydroisoquinolin-1-yl)aniline directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Chloro-n-methyl-2-(1,2,3,4-tetrahydroisoquinolin-1-yl)aniline?
Yes, CoreyChem provides custom synthesis services for 4-Chloro-n-methyl-2-(1,2,3,4-tetrahydroisoquinolin-1-yl)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.