Propylamine, N,N-diethyl-3-(o-methoxyphenyl)-, citrate
TL;DR: Propylamine, N,N-diethyl-3-(o-methoxyphenyl)-, citrate (CAS 112377-23-8) is a chemical compound with molecular formula C20H31NO8 and molecular weight 413.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-diethyl-3-(2-methoxyphenyl)propan-1-amine;2-hydroxypropane-1,2,3-tricarboxylic acid
Also Known As: N,N-Diethyl-3-(o-methoxyphenyl)propylamine citrate, Propylamine, N,N-diethyl-3-(o-methoxyphenyl)-, citrate, N,N-diethyl-3-(2-methoxyphenyl)propan-1-amine; 2-hydroxypropane-1,2,3-tricarboxylic acid, 2-Hydroxypropane-1,2,3-tricarboxylic acid--N,N-diethyl-3-(2-methoxyphenyl)propan-1-amine (1/1), RefChem:375619
| Molecular Formula | C20H31NO8 |
|---|---|
| Molecular Weight | 413.20 g/mol |
| LogP | 1.7211 |
| Topological Polar Surface Area | 144.6 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 12 |
| Exact Mass | 413.20496 |
| Heavy Atoms | 29 |
| Complexity | 641.6362 |
Chemical Identifiers
| CAS Number | 112377-23-8 |
|---|---|
| SMILES | CCN(CC)CCCC1=CC=CC=C1OC.C(C(=O)O)C(CC(=O)O)(C(=O)O)O |
Product Overview
Propylamine, N,N-diethyl-3-(o-methoxyphenyl)-, citrate (CAS 112377-23-8), with molecular formula C20H31NO8 and molecular weight 413.20 g/mol. IUPAC: N,N-diethyl-3-(2-methoxyphenyl)propan-1-amine;2-hydroxypropane-1,2,3-tricarboxylic acid.
Chemical Property Profile of Propylamine, N,N-diethyl-3-(o-methoxyphenyl)-, citrate
Property Insights of Propylamine, N,N-diethyl-3-(o-methoxyphenyl)-, citrate
The XLogP value of 1.7211 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Propylamine, N,N-diethyl-3-(o-methoxyphenyl)-, citrate. The TPSA of 144.6 Ų indicates high polarity, suggesting Propylamine, N,N-diethyl-3-(o-methoxyphenyl)-, citrate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Propylamine, N,N-diethyl-3-(o-methoxyphenyl)-, citrate has 4 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Propylamine, N,N-diethyl-3-(o-methoxyphenyl)-, citrate?
The CAS number of Propylamine, N,N-diethyl-3-(o-methoxyphenyl)-, citrate is 112377-23-8.
What is the molecular formula of Propylamine, N,N-diethyl-3-(o-methoxyphenyl)-, citrate?
The molecular formula of Propylamine, N,N-diethyl-3-(o-methoxyphenyl)-, citrate is C20H31NO8.
What is the molecular weight of Propylamine, N,N-diethyl-3-(o-methoxyphenyl)-, citrate?
The molecular weight of Propylamine, N,N-diethyl-3-(o-methoxyphenyl)-, citrate is 413.20 g/mol.
Where can I buy Propylamine, N,N-diethyl-3-(o-methoxyphenyl)-, citrate?
You can request a quote for Propylamine, N,N-diethyl-3-(o-methoxyphenyl)-, citrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propylamine, N,N-diethyl-3-(o-methoxyphenyl)-, citrate?
Yes, KEHONG BIO provides custom synthesis services for Propylamine, N,N-diethyl-3-(o-methoxyphenyl)-, citrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.