TL;DR: 1-Methyl-7-phenyl-3,4-dihydroisoquinoline (CAS 24464-44-6) is a chemical compound with molecular formula C16H15N and molecular weight 221.12045 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-methyl-7-phenyl-3,4-dihydroisoquinoline
Also Known As: 1-Methyl-7-phenyl-3,4-dihydroisoquinoline, 1-methyl-7-phenyl-3,4-dihydro-isoquinoline, ISOQUINOLINE, 3,4-DIHYDRO-1-METHYL-7-PHENYL-, Isoquinoline,3,4-dihydro-1-methyl-7-phenyl-
| Molecular Formula | C16H15N |
| Molecular Weight | 221.12045 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 12.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 221.12045 Da |
| Heavy Atoms | 17 |
| Complexity | 288.0 |
| SMILES | CC1=NCCC2=C1C=C(C=C2)C3=CC=CC=C3 |
| InChIKey | GTNSCHPRCKRVPJ-UHFFFAOYSA-N |
The XLogP value of 3.3 indicates that 1-Methyl-7-phenyl-3,4-dihydroisoquinoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.4 Ų, 1-Methyl-7-phenyl-3,4-dihydroisoquinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Methyl-7-phenyl-3,4-dihydroisoquinoline has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1-Methyl-7-phenyl-3,4-dihydroisoquinoline is 24464-44-6.
The molecular formula of 1-Methyl-7-phenyl-3,4-dihydroisoquinoline is C16H15N.
The molecular weight of 1-Methyl-7-phenyl-3,4-dihydroisoquinoline is 221.12045 g/mol.
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