RefChem:1073606
TL;DR: RefChem:1073606 (CAS 63937-60-0) is a chemical compound with molecular formula C21H28ClNO2 and molecular weight 361.18085 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6,7-dimethoxy-2-methyl-1-(3-phenylpropyl)-1,2,3,4-tetrahydroisoquinolin-2-ium chloride
Also Known As: Isoquinoline, 1,2,3,4-tetrahydro-6,7-dimethoxy-2-methyl-1-(phenethylmethyl)-, hydrochloride, 1-Phenylpropyl-2-methyl-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline hydrochloride, 6,7-dimethoxy-2-methyl-1-(3-phenylpropyl)-1,2,3,4-tetrahydroisoquinolin-2-ium chloride, Isoquinoline, 1,2,3,4-tetrahydro-6,7-dimethoxy-2-methyl-1-phenyltrimethylene-, hydrochloride, 6,7-Dimethoxy-2-methyl-1-(3-phenylpropyl)-1,2,3,4-tetrahydroisoquinoline--hydrogen chloride (1/1)
Technical Specifications
| Molecular Formula | C21H28ClNO2 |
| Molecular Weight | 361.18085 g/mol |
| XLogP | -0.16 |
| Topological Polar Surface Area (TPSA) | 22.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 361.18085 Da |
| Heavy Atoms | 25 |
| Complexity | 369.0 |
| SMILES | C[NH+]1CCC2=CC(=C(C=C2C1CCCC3=CC=CC=C3)OC)OC.[Cl-] |
| InChIKey | SPTATJKIYXQBEN-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:1073606
Property Insights of RefChem:1073606
The XLogP value of -0.16 indicates that RefChem:1073606 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 22.9 Ų, RefChem:1073606 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1073606 has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of RefChem:1073606?
The CAS number of RefChem:1073606 is 63937-60-0.
What is the molecular formula of RefChem:1073606?
The molecular formula of RefChem:1073606 is C21H28ClNO2.
What is the molecular weight of RefChem:1073606?
The molecular weight of RefChem:1073606 is 361.18085 g/mol.
Where can I buy RefChem:1073606?
You can request a quote for RefChem:1073606 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:1073606?
Yes, CoreyChem provides custom synthesis services for RefChem:1073606 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.