![(3,4-Dimethoxyphenyl)-N-[(furan-2-yl)methyl]methanaminium structure](/static/products/401/40171-98-0.png)
(3,4-Dimethoxyphenyl)-N-[(furan-2-yl)methyl]methanaminium
TL;DR: (3,4-Dimethoxyphenyl)-N-[(furan-2-yl)methyl]methanaminium (CAS 40171-98-0) is a chemical compound with molecular formula C14H18NO3+ and molecular weight 248.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3,4-dimethoxyphenyl)methyl-(furan-2-ylmethyl)azanium
Also Known As: (3,4-dimethoxyphenyl)methyl-(furan-2-ylmethyl)azanium, (3,4-Dimethoxyphenyl)-N-[(furan-2-yl)methyl]methanaminium
| Molecular Formula | C14H18NO3+ |
|---|---|
| Molecular Weight | 248.13 g/mol |
| LogP | 1.5604 |
| Topological Polar Surface Area | 48.21 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 248.12866 |
| Heavy Atoms | 18 |
| Complexity | 479.78925 |
Chemical Identifiers
| CAS Number | 40171-98-0 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C[NH2+]CC2=CC=CO2)OC |
Product Overview
(3,4-Dimethoxyphenyl)-N-[(furan-2-yl)methyl]methanaminium (CAS 40171-98-0), with molecular formula C14H18NO3+ and molecular weight 248.13 g/mol. IUPAC: (3,4-dimethoxyphenyl)methyl-(furan-2-ylmethyl)azanium.
Chemical Property Profile of (3,4-Dimethoxyphenyl)-N-[(furan-2-yl)methyl]methanaminium
Property Insights of (3,4-Dimethoxyphenyl)-N-[(furan-2-yl)methyl]methanaminium
The XLogP value of 1.5604 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3,4-Dimethoxyphenyl)-N-[(furan-2-yl)methyl]methanaminium. With a topological polar surface area (TPSA) of 48.21 Ų, (3,4-Dimethoxyphenyl)-N-[(furan-2-yl)methyl]methanaminium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3,4-Dimethoxyphenyl)-N-[(furan-2-yl)methyl]methanaminium has 1 hydrogen bond donor(s) and 3 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 (3,4-Dimethoxyphenyl)-N-[(furan-2-yl)methyl]methanaminium?
The CAS number of (3,4-Dimethoxyphenyl)-N-[(furan-2-yl)methyl]methanaminium is 40171-98-0.
What is the molecular formula of (3,4-Dimethoxyphenyl)-N-[(furan-2-yl)methyl]methanaminium?
The molecular formula of (3,4-Dimethoxyphenyl)-N-[(furan-2-yl)methyl]methanaminium is C14H18NO3+.
What is the molecular weight of (3,4-Dimethoxyphenyl)-N-[(furan-2-yl)methyl]methanaminium?
The molecular weight of (3,4-Dimethoxyphenyl)-N-[(furan-2-yl)methyl]methanaminium is 248.13 g/mol.
Where can I buy (3,4-Dimethoxyphenyl)-N-[(furan-2-yl)methyl]methanaminium?
You can request a quote for (3,4-Dimethoxyphenyl)-N-[(furan-2-yl)methyl]methanaminium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3,4-Dimethoxyphenyl)-N-[(furan-2-yl)methyl]methanaminium?
Yes, KEHONG BIO provides custom synthesis services for (3,4-Dimethoxyphenyl)-N-[(furan-2-yl)methyl]methanaminium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.