![N-(4-ethoxybenzyl)-1,3,5-triazatricyclo[3.3.1.1~3,7~]decan-7-amine structure](/static/products/3125/312506-80-2.webp)
N-(4-ethoxybenzyl)-1,3,5-triazatricyclo[3.3.1.1~3,7~]decan-7-amine
TL;DR: N-(4-ethoxybenzyl)-1,3,5-triazatricyclo[3.3.1.1~3,7~]decan-7-amine (CAS 312506-80-2) is a chemical compound with molecular formula C16H24N4O and molecular weight 288.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(4-ethoxyphenyl)methyl]-1,3,5-triazatricyclo[3.3.1.13,7]decan-7-amine
Also Known As: BAS 02107984, BIM-0036322.P001, N-(4-ethoxybenzyl)-1,3,5-triazaadamantan-7-amine, (4-Ethoxy-benzyl)-(1,3,5-triaza-tricyclo[3.3.1.1*3,7*]dec-7-yl)-amine, N-(4-ethoxybenzyl)-1,3,5-triazatricyclo[3.3.1.1~3,7~]decan-7-amine
| Molecular Formula | C16H24N4O |
|---|---|
| Molecular Weight | 288.19 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 31.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 288.195 |
| Heavy Atoms | 21 |
| Complexity | 326.0 |
Chemical Identifiers
| CAS Number | 312506-80-2 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)CNC23CN4CN(C2)CN(C3)C4 |
| InChIKey | PDCISGKZFDGSHO-UHFFFAOYSA-N |
Product Overview
N-(4-ethoxybenzyl)-1,3,5-triazatricyclo[3.3.1.1~3,7~]decan-7-amine (CAS 312506-80-2), with molecular formula C16H24N4O and molecular weight 288.19 g/mol. IUPAC: N-[(4-ethoxyphenyl)methyl]-1,3,5-triazatricyclo[3.3.1.13,7]decan-7-amine.
Chemical Property Profile of N-(4-ethoxybenzyl)-1,3,5-triazatricyclo[3.3.1.1~3,7~]decan-7-amine
Property Insights of N-(4-ethoxybenzyl)-1,3,5-triazatricyclo[3.3.1.1~3,7~]decan-7-amine
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-ethoxybenzyl)-1,3,5-triazatricyclo[3.3.1.1~3,7~]decan-7-amine. With a topological polar surface area (TPSA) of 31.0 Ų, N-(4-ethoxybenzyl)-1,3,5-triazatricyclo[3.3.1.1~3,7~]decan-7-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-ethoxybenzyl)-1,3,5-triazatricyclo[3.3.1.1~3,7~]decan-7-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 N-(4-ethoxybenzyl)-1,3,5-triazatricyclo[3.3.1.1~3,7~]decan-7-amine?
The CAS number of N-(4-ethoxybenzyl)-1,3,5-triazatricyclo[3.3.1.1~3,7~]decan-7-amine is 312506-80-2.
What is the molecular formula of N-(4-ethoxybenzyl)-1,3,5-triazatricyclo[3.3.1.1~3,7~]decan-7-amine?
The molecular formula of N-(4-ethoxybenzyl)-1,3,5-triazatricyclo[3.3.1.1~3,7~]decan-7-amine is C16H24N4O.
What is the molecular weight of N-(4-ethoxybenzyl)-1,3,5-triazatricyclo[3.3.1.1~3,7~]decan-7-amine?
The molecular weight of N-(4-ethoxybenzyl)-1,3,5-triazatricyclo[3.3.1.1~3,7~]decan-7-amine is 288.19 g/mol.
Where can I buy N-(4-ethoxybenzyl)-1,3,5-triazatricyclo[3.3.1.1~3,7~]decan-7-amine?
You can request a quote for N-(4-ethoxybenzyl)-1,3,5-triazatricyclo[3.3.1.1~3,7~]decan-7-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-ethoxybenzyl)-1,3,5-triazatricyclo[3.3.1.1~3,7~]decan-7-amine?
Yes, KEHONG BIO provides custom synthesis services for N-(4-ethoxybenzyl)-1,3,5-triazatricyclo[3.3.1.1~3,7~]decan-7-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.