Benzylamine, N-(3-(p-chlorophenyl)propyl)-3,4-dimethoxy-N-ethyl-, fumarate
TL;DR: Benzylamine, N-(3-(p-chlorophenyl)propyl)-3,4-dimethoxy-N-ethyl-, fumarate (CAS 5281-32-3) is a chemical compound with molecular formula C24H30ClNO6 and molecular weight 463.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-chlorophenyl)propyl-[(3,4-dimethoxyphenyl)methyl]-ethylazanium;(E)-4-hydroxy-4-oxobut-2-enoate
Also Known As: BENZYLAMINE, N-(3-(p-CHLOROPHENYL)PROPYL)-3,4-DIMETHOXY-N-ETHYL-, FUMARATE, N-(3-(p-Chlorophenyl)propyl)-3,4-dimethoxy-N-ethylbenzylamine fumarate, 3-(4-chlorophenyl)propyl-[(3,4-dimethoxyphenyl)methyl]-ethylazanium; (E)-4-hydroxy-4-oxobut-2-enoate, Benzenepropanamine, 4-chloro-N-[(3,4-dimethoxyphenyl)methyl]-N-ethyl-, (E)-2-butenedioate (1:1), RefChem:1079519
| Molecular Formula | C24H30ClNO6 |
|---|---|
| Molecular Weight | 463.18 g/mol |
| LogP | 1.7719 |
| Topological Polar Surface Area | 100.33 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 11 |
| Exact Mass | 463.17618 |
| Heavy Atoms | 32 |
| Complexity | 866.5582 |
Chemical Identifiers
| CAS Number | 5281-32-3 |
|---|---|
| SMILES | CC[NH+](CCCC1=CC=C(C=C1)Cl)CC2=CC(=C(C=C2)OC)OC.C(=C/C(=O)[O-])\C(=O)O |
Product Overview
Benzylamine, N-(3-(p-chlorophenyl)propyl)-3,4-dimethoxy-N-ethyl-, fumarate (CAS 5281-32-3), with molecular formula C24H30ClNO6 and molecular weight 463.18 g/mol. IUPAC: 3-(4-chlorophenyl)propyl-[(3,4-dimethoxyphenyl)methyl]-ethylazanium;(E)-4-hydroxy-4-oxobut-2-enoate.
Chemical Property Profile of Benzylamine, N-(3-(p-chlorophenyl)propyl)-3,4-dimethoxy-N-ethyl-, fumarate
Property Insights of Benzylamine, N-(3-(p-chlorophenyl)propyl)-3,4-dimethoxy-N-ethyl-, fumarate
The XLogP value of 1.7719 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzylamine, N-(3-(p-chlorophenyl)propyl)-3,4-dimethoxy-N-ethyl-, fumarate. The TPSA of 100.33 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzylamine, N-(3-(p-chlorophenyl)propyl)-3,4-dimethoxy-N-ethyl-, fumarate. Following Lipinski's Rule of Five, Benzylamine, N-(3-(p-chlorophenyl)propyl)-3,4-dimethoxy-N-ethyl-, fumarate has 2 hydrogen bond donor(s) and 5 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 Benzylamine, N-(3-(p-chlorophenyl)propyl)-3,4-dimethoxy-N-ethyl-, fumarate?
The CAS number of Benzylamine, N-(3-(p-chlorophenyl)propyl)-3,4-dimethoxy-N-ethyl-, fumarate is 5281-32-3.
What is the molecular formula of Benzylamine, N-(3-(p-chlorophenyl)propyl)-3,4-dimethoxy-N-ethyl-, fumarate?
The molecular formula of Benzylamine, N-(3-(p-chlorophenyl)propyl)-3,4-dimethoxy-N-ethyl-, fumarate is C24H30ClNO6.
What is the molecular weight of Benzylamine, N-(3-(p-chlorophenyl)propyl)-3,4-dimethoxy-N-ethyl-, fumarate?
The molecular weight of Benzylamine, N-(3-(p-chlorophenyl)propyl)-3,4-dimethoxy-N-ethyl-, fumarate is 463.18 g/mol.
Where can I buy Benzylamine, N-(3-(p-chlorophenyl)propyl)-3,4-dimethoxy-N-ethyl-, fumarate?
You can request a quote for Benzylamine, N-(3-(p-chlorophenyl)propyl)-3,4-dimethoxy-N-ethyl-, fumarate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzylamine, N-(3-(p-chlorophenyl)propyl)-3,4-dimethoxy-N-ethyl-, fumarate?
Yes, KEHONG BIO provides custom synthesis services for Benzylamine, N-(3-(p-chlorophenyl)propyl)-3,4-dimethoxy-N-ethyl-, fumarate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.