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1-(3-Diethylamino-2-hydroxypropyl)amino-4,5-dimethyl-5H-pyrido(4,3-b)indole dihydrochloride structure
Fine Chemical

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)

CAS Number
111380-36-0
Molecular Formula
C20H30Cl2N4O2
Molecular Weight
428.1746 g/mol
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Technical Specifications

Molecular FormulaC20H30Cl2N4O2
Molecular Weight428.1746 g/mol
XLogP3.69872
Topological Polar Surface Area (TPSA)73.6 Ų
Hydrogen Bond Donors5
Hydrogen Bond Acceptors5
Rotatable Bonds7
Exact Mass428.1746 Da
Heavy Atoms28
Complexity448.0
SMILESCCN(CC)CC(CNC1=NC=C(C2=C1C3=C(N2C)C=CC(=C3)O)C)O.Cl.Cl
InChIKeyZJYJBBOONJZZBE-UHFFFAOYSA-N

Product Description

Applications: AC1L4CM8 is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).

AC1L4CM8 (CAS 111380-36-0) is a fine chemical with the molecular formula C20H30Cl2N4O2 and a molecular weight of 428.17 g/mol. Synonyms include 1-(3-Diethylamino-2-hydroxypropyl)amino-4,5-dimethyl-5H-pyrido(4,3-b)indole dihydrochloride and 1-[[3-(diethylamino)-2-hydroxypropyl]amino]-4,5-dimethylpyrido[4,3-b]indol-8-ol dihydrochloride.

Custom synthesis (mg to ton scale), HPLC/NMR/MS analytical support, and complete COA/MSDS documentation are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.

Chemical Property Profile of 1-(3-Diethylamino-2-hydroxypropyl)amino-4,5-dimethyl-5H-pyrido(4,3-b)indole dihydrochloride

XLogP
3.69872
TPSA (Topological Polar Surface Area)
73.6
Hydrogen Bond Donors
5
Hydrogen Bond Acceptors
5
Rotatable Bonds
7
Heavy Atoms
28
Complexity
448.0
Exact Mass
428.1746
Monoisotopic Mass
428.1746
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

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.

What are the applications of 1-(3-Diethylamino-2-hydroxypropyl)amino-4,5-dimethyl-5H-pyrido(4,3-b)indole dihydrochloride?

AC1L4CM8 is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).

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.

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