13-(4-Methoxybenzyl)-1,4,7,10-tetraoxa-13-azacyclopentadecane
TL;DR: 13-(4-Methoxybenzyl)-1,4,7,10-tetraoxa-13-azacyclopentadecane (CAS 110116-85-3) is a chemical compound with molecular formula C18H29NO5 and molecular weight 339.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
13-[(4-methoxyphenyl)methyl]-1,4,7,10-tetraoxa-13-azacyclopentadecane
Also Known As: 13-(4-methoxybenzyl)-1,4,7,10-tetraoxa-13-azacyclopentadecane, 13-[(4-methoxyphenyl)methyl]-1,4,7,10-tetraoxa-13-azacyclopentadecane, 13-(4-Methoxy-benzyl)-1,4,7,10-tetraoxa-13-aza-cyclopentadecane
| Molecular Formula | C18H29NO5 |
|---|---|
| Molecular Weight | 339.20 g/mol |
| LogP | 1.5772 |
| Topological Polar Surface Area | 49.39 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 339.20456 |
| Heavy Atoms | 24 |
| Complexity | 409.9222 |
Chemical Identifiers
| CAS Number | 110116-85-3 |
|---|---|
| SMILES | COC1=CC=C(C=C1)CN2CCOCCOCCOCCOCC2 |
Product Overview
13-(4-Methoxybenzyl)-1,4,7,10-tetraoxa-13-azacyclopentadecane (CAS 110116-85-3), with molecular formula C18H29NO5 and molecular weight 339.20 g/mol. IUPAC: 13-[(4-methoxyphenyl)methyl]-1,4,7,10-tetraoxa-13-azacyclopentadecane.
Chemical Property Profile of 13-(4-Methoxybenzyl)-1,4,7,10-tetraoxa-13-azacyclopentadecane
Property Insights of 13-(4-Methoxybenzyl)-1,4,7,10-tetraoxa-13-azacyclopentadecane
The XLogP value of 1.5772 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 13-(4-Methoxybenzyl)-1,4,7,10-tetraoxa-13-azacyclopentadecane. With a topological polar surface area (TPSA) of 49.39 Ų, 13-(4-Methoxybenzyl)-1,4,7,10-tetraoxa-13-azacyclopentadecane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 13-(4-Methoxybenzyl)-1,4,7,10-tetraoxa-13-azacyclopentadecane has 0 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 13-(4-Methoxybenzyl)-1,4,7,10-tetraoxa-13-azacyclopentadecane?
The CAS number of 13-(4-Methoxybenzyl)-1,4,7,10-tetraoxa-13-azacyclopentadecane is 110116-85-3.
What is the molecular formula of 13-(4-Methoxybenzyl)-1,4,7,10-tetraoxa-13-azacyclopentadecane?
The molecular formula of 13-(4-Methoxybenzyl)-1,4,7,10-tetraoxa-13-azacyclopentadecane is C18H29NO5.
What is the molecular weight of 13-(4-Methoxybenzyl)-1,4,7,10-tetraoxa-13-azacyclopentadecane?
The molecular weight of 13-(4-Methoxybenzyl)-1,4,7,10-tetraoxa-13-azacyclopentadecane is 339.20 g/mol.
Where can I buy 13-(4-Methoxybenzyl)-1,4,7,10-tetraoxa-13-azacyclopentadecane?
You can request a quote for 13-(4-Methoxybenzyl)-1,4,7,10-tetraoxa-13-azacyclopentadecane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 13-(4-Methoxybenzyl)-1,4,7,10-tetraoxa-13-azacyclopentadecane?
Yes, KEHONG BIO provides custom synthesis services for 13-(4-Methoxybenzyl)-1,4,7,10-tetraoxa-13-azacyclopentadecane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.