Bis(3,4-dimethoxybenzyl)amine
TL;DR: Bis(3,4-dimethoxybenzyl)amine (CAS 5634-21-9) is a chemical compound with molecular formula C18H23NO4 and molecular weight 317.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3,4-dimethoxyphenyl)-N-[(3,4-dimethoxyphenyl)methyl]methanamine
Also Known As: bis(3,4-dimethoxybenzyl)amine, N,N-di(3,4-dimethoxybenzyl)amine, N,N-bis(3,4-dimethoxybenzyl)amine, bis[(3,4-dimethoxyphenyl)methyl]amine, N-(3,4-dimethoxybenzyl)-1-(3,4-dimethoxyphenyl)methanamine
| Molecular Formula | C18H23NO4 |
|---|---|
| Molecular Weight | 317.16 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 49.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 317.16272 |
| Heavy Atoms | 23 |
| Complexity | 298.0 |
Chemical Identifiers
| CAS Number | 5634-21-9 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CNCC2=CC(=C(C=C2)OC)OC)OC |
| InChIKey | ZAHBSOCTGNBCSC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Bis(3,4-dimethoxybenzyl)amine (CAS 5634-21-9), with molecular formula C18H23NO4 and molecular weight 317.16 g/mol. IUPAC: 1-(3,4-dimethoxyphenyl)-N-[(3,4-dimethoxyphenyl)methyl]methanamine.
Chemical Property Profile of Bis(3,4-dimethoxybenzyl)amine
Property Insights of Bis(3,4-dimethoxybenzyl)amine
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bis(3,4-dimethoxybenzyl)amine. With a topological polar surface area (TPSA) of 49.0 Ų, Bis(3,4-dimethoxybenzyl)amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bis(3,4-dimethoxybenzyl)amine has 1 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 Bis(3,4-dimethoxybenzyl)amine?
The CAS number of Bis(3,4-dimethoxybenzyl)amine is 5634-21-9.
What is the molecular formula of Bis(3,4-dimethoxybenzyl)amine?
The molecular formula of Bis(3,4-dimethoxybenzyl)amine is C18H23NO4.
What is the molecular weight of Bis(3,4-dimethoxybenzyl)amine?
The molecular weight of Bis(3,4-dimethoxybenzyl)amine is 317.16 g/mol.
Where can I buy Bis(3,4-dimethoxybenzyl)amine?
You can request a quote for Bis(3,4-dimethoxybenzyl)amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bis(3,4-dimethoxybenzyl)amine?
Yes, KEHONG BIO provides custom synthesis services for Bis(3,4-dimethoxybenzyl)amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.