TL;DR: 5H-Pyrido(4,3-b)indol-8-ol, 1-((3-(dimethylamino)propyl)amino)- (CAS 111380-41-7) is a chemical compound with molecular formula C16H20N4O and molecular weight 284.1637 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[3-(dimethylamino)propylamino]-5H-pyrido[4,3-b]indol-8-ol
Also Known As: 5H-Pyrido(4,3-b)indol-8-ol, 1-((3-(dimethylamino)propyl)amino)-, 1-[3-(dimethylamino)propylamino]-5H-pyrido[4,3-b]indol-8-ol
| Molecular Formula | C16H20N4O |
| Molecular Weight | 284.1637 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 64.2 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 284.1637 Da |
| Heavy Atoms | 21 |
| Complexity | 338.0 |
| SMILES | CN(C)CCCNC1=NC=CC2=C1C3=C(N2)C=CC(=C3)O |
| InChIKey | UTUWDTGTORKSAW-UHFFFAOYSA-N |
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5H-Pyrido(4,3-b)indol-8-ol, 1-((3-(dimethylamino)propyl)amino)-. The TPSA of 64.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 5H-Pyrido(4,3-b)indol-8-ol, 1-((3-(dimethylamino)propyl)amino)-. Following Lipinski's Rule of Five, 5H-Pyrido(4,3-b)indol-8-ol, 1-((3-(dimethylamino)propyl)amino)- has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 5H-Pyrido(4,3-b)indol-8-ol, 1-((3-(dimethylamino)propyl)amino)- is 111380-41-7.
The molecular formula of 5H-Pyrido(4,3-b)indol-8-ol, 1-((3-(dimethylamino)propyl)amino)- is C16H20N4O.
The molecular weight of 5H-Pyrido(4,3-b)indol-8-ol, 1-((3-(dimethylamino)propyl)amino)- is 284.1637 g/mol.
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