1,3-Propanediamine, N-(5-chloro-3-(4-methylphenyl)-1H-indol-1-yl)-N,N',N'-trimethyl-, monohydrochloride
TL;DR: 1,3-Propanediamine, N-(5-chloro-3-(4-methylphenyl)-1H-indol-1-yl)-N,N',N'-trimethyl-, monohydrochloride (CAS 57647-40-2) is a chemical compound with molecular formula C21H27Cl2N3 and molecular weight 391.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-[5-chloro-3-(4-methylphenyl)indol-1-yl]-N,N,N'-trimethylpropane-1,3-diamine;hydrochloride
Also Known As: 1,3-Propanediamine, N-(5-chloro-3-(4-methylphenyl)-1H-indol-1-yl)-N,N',N'-trimethyl-, monohydrochloride, N-(5-Chloro-3-(4-methylphenyl)-1H-indol-1-yl)-N,N',N'-trimethyl-1,3-propanediamine HCl, N'-[5-chloro-3-(4-methylphenyl)indol-1-yl]-N,N,N'-trimethylpropane-1,3-diamine hydrochloride, N~1~-[5-Chloro-3-(4-methylphenyl)-1H-indol-1-yl]-N~1~,N~3~,N~3~-trimethylpropane-1,3-diamine--hydrogen chloride (1/1), RefChem:219522
| Molecular Formula | C21H27Cl2N3 |
|---|---|
| Molecular Weight | 391.16 g/mol |
| LogP | 5.21142 |
| Topological Polar Surface Area | 11.41 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 391.1582 |
| Heavy Atoms | 26 |
| Complexity | 853.5687 |
Chemical Identifiers
| CAS Number | 57647-40-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=CN(C3=C2C=C(C=C3)Cl)N(C)CCCN(C)C.Cl |
Product Overview
1,3-Propanediamine, N-(5-chloro-3-(4-methylphenyl)-1H-indol-1-yl)-N,N',N'-trimethyl-, monohydrochloride (CAS 57647-40-2), with molecular formula C21H27Cl2N3 and molecular weight 391.16 g/mol. IUPAC: N'-[5-chloro-3-(4-methylphenyl)indol-1-yl]-N,N,N'-trimethylpropane-1,3-diamine;hydrochloride.
Chemical Property Profile of 1,3-Propanediamine, N-(5-chloro-3-(4-methylphenyl)-1H-indol-1-yl)-N,N',N'-trimethyl-, monohydrochloride
Property Insights of 1,3-Propanediamine, N-(5-chloro-3-(4-methylphenyl)-1H-indol-1-yl)-N,N',N'-trimethyl-, monohydrochloride
The XLogP value of 5.21142 indicates that 1,3-Propanediamine, N-(5-chloro-3-(4-methylphenyl)-1H-indol-1-yl)-N,N',N'-trimethyl-, monohydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 11.41 Ų, 1,3-Propanediamine, N-(5-chloro-3-(4-methylphenyl)-1H-indol-1-yl)-N,N',N'-trimethyl-, monohydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Propanediamine, N-(5-chloro-3-(4-methylphenyl)-1H-indol-1-yl)-N,N',N'-trimethyl-, monohydrochloride has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,3-Propanediamine, N-(5-chloro-3-(4-methylphenyl)-1H-indol-1-yl)-N,N',N'-trimethyl-, monohydrochloride?
The CAS number of 1,3-Propanediamine, N-(5-chloro-3-(4-methylphenyl)-1H-indol-1-yl)-N,N',N'-trimethyl-, monohydrochloride is 57647-40-2.
What is the molecular formula of 1,3-Propanediamine, N-(5-chloro-3-(4-methylphenyl)-1H-indol-1-yl)-N,N',N'-trimethyl-, monohydrochloride?
The molecular formula of 1,3-Propanediamine, N-(5-chloro-3-(4-methylphenyl)-1H-indol-1-yl)-N,N',N'-trimethyl-, monohydrochloride is C21H27Cl2N3.
What is the molecular weight of 1,3-Propanediamine, N-(5-chloro-3-(4-methylphenyl)-1H-indol-1-yl)-N,N',N'-trimethyl-, monohydrochloride?
The molecular weight of 1,3-Propanediamine, N-(5-chloro-3-(4-methylphenyl)-1H-indol-1-yl)-N,N',N'-trimethyl-, monohydrochloride is 391.16 g/mol.
Where can I buy 1,3-Propanediamine, N-(5-chloro-3-(4-methylphenyl)-1H-indol-1-yl)-N,N',N'-trimethyl-, monohydrochloride?
You can request a quote for 1,3-Propanediamine, N-(5-chloro-3-(4-methylphenyl)-1H-indol-1-yl)-N,N',N'-trimethyl-, monohydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Propanediamine, N-(5-chloro-3-(4-methylphenyl)-1H-indol-1-yl)-N,N',N'-trimethyl-, monohydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Propanediamine, N-(5-chloro-3-(4-methylphenyl)-1H-indol-1-yl)-N,N',N'-trimethyl-, monohydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.