TL;DR: 1-(4-methoxyphenyl)-6-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole (CAS 1431962-16-1) is a chemical compound with molecular formula C19H20N2O and molecular weight 292.15756 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(4-methoxyphenyl)-6-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
Also Known As: 1-(4-methoxyphenyl)-6-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole, 1-(4-methoxyphenyl)-6-methyl-2,3,4,9-tetrahydro-1H-beta-carboline, 1-(4-METHOXYPHENYL)-6-METHYL-1H,2H,3H,4H,9H-PYRIDO[3,4-B]INDOLE, 1-(4-methoxyphenyl)-6-methyl-1H,2H,3H,4H,9H-pyrido3,4-bindole, 4-methoxy-1-(6-methyl(1,2,3,4-tetrahydrobeta-carbolinyl))benzene
| Molecular Formula | C19H20N2O |
| Molecular Weight | 292.15756 g/mol |
| XLogP | 3.5 |
| Topological Polar Surface Area (TPSA) | 37.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 292.15756 Da |
| Heavy Atoms | 22 |
| Complexity | 380.0 |
| SMILES | CC1=CC2=C(C=C1)NC3=C2CCNC3C4=CC=C(C=C4)OC |
| InChIKey | VFUYROFTDOIHPO-UHFFFAOYSA-N |
The XLogP value of 3.5 indicates that 1-(4-methoxyphenyl)-6-methyl-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 37.1 Ų, 1-(4-methoxyphenyl)-6-methyl-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-(4-methoxyphenyl)-6-methyl-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-(4-methoxyphenyl)-6-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole is 1431962-16-1.
The molecular formula of 1-(4-methoxyphenyl)-6-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole is C19H20N2O.
The molecular weight of 1-(4-methoxyphenyl)-6-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole is 292.15756 g/mol.
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