1-(3-Diethylamino-2-hydroxypropyl)amino-4,5-dimethyl-5H-pyrido(4,3-b)indole dihydrochloride
TL;DR: 1-(3-Diethylamino-2-hydroxypropyl)amino-4,5-dimethyl-5H-pyrido(4,3-b)indole dihydrochloride (CAS 111380-36-0) is a chemical compound with molecular formula C20H30Cl2N4O2 and molecular weight 428.1746 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[[3-(diethylamino)-2-hydroxypropyl]amino]-4,5-dimethylpyrido[4,3-b]indol-8-ol;dihydrochloride
Also Known As: 1-(3-Diethylamino-2-hydroxypropyl)amino-4,5-dimethyl-5H-pyrido(4,3-b)indole dihydrochloride, 1-[[3-(diethylamino)-2-hydroxypropyl]amino]-4,5-dimethylpyrido[4,3-b]indol-8-ol dihydrochloride, 1-{[3-(Diethylamino)-2-hydroxypropyl]amino}-4,5-dimethyl-5H-pyrido[4,3-b]indol-8-ol--hydrogen chloride (1/2)
Technical Specifications
| Molecular Formula | C20H30Cl2N4O2 |
| Molecular Weight | 428.1746 g/mol |
| XLogP | 3.69872 |
| Topological Polar Surface Area (TPSA) | 73.6 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 428.1746 Da |
| Heavy Atoms | 28 |
| Complexity | 448.0 |
| SMILES | CCN(CC)CC(CNC1=NC=C(C2=C1C3=C(N2C)C=CC(=C3)O)C)O.Cl.Cl |
| InChIKey | ZJYJBBOONJZZBE-UHFFFAOYSA-N |
Chemical Property Profile of 1-(3-Diethylamino-2-hydroxypropyl)amino-4,5-dimethyl-5H-pyrido(4,3-b)indole dihydrochloride
Property Insights of 1-(3-Diethylamino-2-hydroxypropyl)amino-4,5-dimethyl-5H-pyrido(4,3-b)indole dihydrochloride
The XLogP value of 3.69872 indicates that 1-(3-Diethylamino-2-hydroxypropyl)amino-4,5-dimethyl-5H-pyrido(4,3-b)indole dihydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(3-Diethylamino-2-hydroxypropyl)amino-4,5-dimethyl-5H-pyrido(4,3-b)indole dihydrochloride. Following Lipinski's Rule of Five, 1-(3-Diethylamino-2-hydroxypropyl)amino-4,5-dimethyl-5H-pyrido(4,3-b)indole dihydrochloride has 5 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-(3-Diethylamino-2-hydroxypropyl)amino-4,5-dimethyl-5H-pyrido(4,3-b)indole dihydrochloride?
The CAS number of 1-(3-Diethylamino-2-hydroxypropyl)amino-4,5-dimethyl-5H-pyrido(4,3-b)indole dihydrochloride is 111380-36-0.
What is the molecular formula of 1-(3-Diethylamino-2-hydroxypropyl)amino-4,5-dimethyl-5H-pyrido(4,3-b)indole dihydrochloride?
The molecular formula of 1-(3-Diethylamino-2-hydroxypropyl)amino-4,5-dimethyl-5H-pyrido(4,3-b)indole dihydrochloride is C20H30Cl2N4O2.
What is the molecular weight of 1-(3-Diethylamino-2-hydroxypropyl)amino-4,5-dimethyl-5H-pyrido(4,3-b)indole dihydrochloride?
The molecular weight of 1-(3-Diethylamino-2-hydroxypropyl)amino-4,5-dimethyl-5H-pyrido(4,3-b)indole dihydrochloride is 428.1746 g/mol.
Where can I buy 1-(3-Diethylamino-2-hydroxypropyl)amino-4,5-dimethyl-5H-pyrido(4,3-b)indole dihydrochloride?
You can request a quote for 1-(3-Diethylamino-2-hydroxypropyl)amino-4,5-dimethyl-5H-pyrido(4,3-b)indole dihydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(3-Diethylamino-2-hydroxypropyl)amino-4,5-dimethyl-5H-pyrido(4,3-b)indole dihydrochloride?
Yes, CoreyChem provides custom synthesis services for 1-(3-Diethylamino-2-hydroxypropyl)amino-4,5-dimethyl-5H-pyrido(4,3-b)indole dihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.