TL;DR: 11-methyl-1,4-diphenyl-5H-[1,2,5]triazepino[5,4-a]indole (CAS 163158-97-2) is a chemical compound with molecular formula C24H19N3 and molecular weight 349.1579 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
11-methyl-1,4-diphenyl-5H-[1,2,5]triazepino[5,4-a]indole
Also Known As: 11-methyl-1,4-diphenyl-5H-[1,2,5]triazepino[5,4-a]indole, AH-034/34962050, 11-methyl-1,4-diphenyl5h-[1,2,5]triazepino[5,4-a]indole
| Molecular Formula | C24H19N3 |
| Molecular Weight | 349.1579 g/mol |
| XLogP | 5.9 |
| Topological Polar Surface Area (TPSA) | 29.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 349.1579 Da |
| Heavy Atoms | 27 |
| Complexity | 582.0 |
| SMILES | CC1=C2C(=NN=C(CN2C3=CC=CC=C13)C4=CC=CC=C4)C5=CC=CC=C5 |
| InChIKey | BPQRERUKZOMJNQ-UHFFFAOYSA-N |
The XLogP value of 5.9 indicates that 11-methyl-1,4-diphenyl-5H-[1,2,5]triazepino[5,4-a]indole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.7 Ų, 11-methyl-1,4-diphenyl-5H-[1,2,5]triazepino[5,4-a]indole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 11-methyl-1,4-diphenyl-5H-[1,2,5]triazepino[5,4-a]indole has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 11-methyl-1,4-diphenyl-5H-[1,2,5]triazepino[5,4-a]indole is 163158-97-2.
The molecular formula of 11-methyl-1,4-diphenyl-5H-[1,2,5]triazepino[5,4-a]indole is C24H19N3.
The molecular weight of 11-methyl-1,4-diphenyl-5H-[1,2,5]triazepino[5,4-a]indole is 349.1579 g/mol.
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