TL;DR: 6,7-Dimethyl-1-[(4-methylphenyl)methyl]isoquinoline (CAS 1024214-04-7) is a chemical compound with molecular formula C19H19N and molecular weight 261.15176 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6,7-dimethyl-1-[(4-methylphenyl)methyl]isoquinoline
Also Known As: 6,7-dimethyl-1-[(4-methylphenyl)methyl]isoquinoline, Isoquinoline, 6,7-dimethyl-1-[(4-methylphenyl)methyl]-
| Molecular Formula | C19H19N |
| Molecular Weight | 261.15176 g/mol |
| XLogP | 5.2 |
| Topological Polar Surface Area (TPSA) | 12.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 261.15176 Da |
| Heavy Atoms | 20 |
| Complexity | 305.0 |
| SMILES | CC1=CC=C(C=C1)CC2=NC=CC3=C2C=C(C(=C3)C)C |
| InChIKey | INJFVWZSQNXEGV-UHFFFAOYSA-N |
The XLogP value of 5.2 indicates that 6,7-Dimethyl-1-[(4-methylphenyl)methyl]isoquinoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.9 Ų, 6,7-Dimethyl-1-[(4-methylphenyl)methyl]isoquinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6,7-Dimethyl-1-[(4-methylphenyl)methyl]isoquinoline has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 6,7-Dimethyl-1-[(4-methylphenyl)methyl]isoquinoline is 1024214-04-7.
The molecular formula of 6,7-Dimethyl-1-[(4-methylphenyl)methyl]isoquinoline is C19H19N.
The molecular weight of 6,7-Dimethyl-1-[(4-methylphenyl)methyl]isoquinoline is 261.15176 g/mol.
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