TL;DR: RefChem:349907 (CAS 63937-77-9) is a chemical compound with molecular formula C24H30ClNO2 and molecular weight 399.1965 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[2-(4-chlorophenyl)ethyl]-6,7-dimethoxy-2-(3-methylbut-2-enyl)-3,4-dihydro-1H-isoquinoline
Also Known As: 1-(4-Chlorophenethyl)-6,7-dimethoxy-2-(3-methylbut-2-enyl)-1,2,3,4-tetrahydroisoquinoline, Isoquinoline, 1,2,3,4-tetrahydro-1-(4-chlorophenethyl)-6,7-dimethoxy-2-(3-methylbut-2-enyl)-, 1-[2-(4-chlorophenyl)ethyl]-6,7-dimethoxy-2-(3-methylbut-2-enyl)-3,4-dihydro-1H-isoquinoline, 1-(4-Chlorophenethyl)-6,7-dimethoxy-2-(3-methylbut-2-en-1-yl)-1,2,3,4-tetrahydroisoquinoline, ISOQUINOLINE, 1,2,3,4-TETRAHYDRO-1-(4-CHLOROPHENETHYL)-6,7-DIMETHOXY-2-(3-METHYL
| Molecular Formula | C24H30ClNO2 |
| Molecular Weight | 399.1965 g/mol |
| XLogP | 6.2 |
| Topological Polar Surface Area (TPSA) | 21.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 399.1965 Da |
| Heavy Atoms | 28 |
| Complexity | 499.0 |
| SMILES | CC(=CCN1CCC2=CC(=C(C=C2C1CCC3=CC=C(C=C3)Cl)OC)OC)C |
| InChIKey | GJFGPQLNCBQNPS-UHFFFAOYSA-N |
The XLogP value of 6.2 indicates that RefChem:349907 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 21.7 Ų, RefChem:349907 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:349907 has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of RefChem:349907 is 63937-77-9.
The molecular formula of RefChem:349907 is C24H30ClNO2.
The molecular weight of RefChem:349907 is 399.1965 g/mol.
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