TL;DR: 1-(2-fluorophenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole (CAS 121208-37-5) is a chemical compound with molecular formula C17H15FN2 and molecular weight 266.12192 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(2-fluorophenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
Also Known As: 1-(2-fluorophenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole, 1-(2-fluorophenyl)-2,3,4,9-tetrahydro-1H-beta-carboline
| Molecular Formula | C17H15FN2 |
| Molecular Weight | 266.12192 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 27.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 266.12192 Da |
| Heavy Atoms | 20 |
| Complexity | 348.0 |
| SMILES | C1CNC(C2=C1C3=CC=CC=C3N2)C4=CC=CC=C4F |
| InChIKey | HICUPXVNZAHKJG-UHFFFAOYSA-N |
The XLogP value of 3.3 indicates that 1-(2-fluorophenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 27.8 Ų, 1-(2-fluorophenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2-fluorophenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1-(2-fluorophenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole is 121208-37-5.
The molecular formula of 1-(2-fluorophenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole is C17H15FN2.
The molecular weight of 1-(2-fluorophenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole is 266.12192 g/mol.
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