4-(Azepan-1-yliminomethyl)-2-iodo-6-methoxyphenol
TL;DR: 4-(Azepan-1-yliminomethyl)-2-iodo-6-methoxyphenol (CAS 16987-35-2) is a chemical compound with molecular formula C14H19IN2O2 and molecular weight 374.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(azepan-1-yliminomethyl)-2-iodo-6-methoxyphenol
Also Known As: NCIOpen2_008976, (4Z)-4-[(azepan-1-ylamino)methylidene]-2-iodo-6-methoxycyclo
| Molecular Formula | C14H19IN2O2 |
|---|---|
| Molecular Weight | 374.05 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 45.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 374.04913 |
| Heavy Atoms | 19 |
| Complexity | 293.0 |
Chemical Identifiers
| CAS Number | 16987-35-2 |
|---|---|
| SMILES | COC1=C(C(=CC(=C1)C=NN2CCCCCC2)I)O |
| InChIKey | WLMNJVKGNSNJKW-UHFFFAOYSA-N |
Product Overview
4-(Azepan-1-yliminomethyl)-2-iodo-6-methoxyphenol (CAS 16987-35-2), with molecular formula C14H19IN2O2 and molecular weight 374.05 g/mol. IUPAC: 4-(azepan-1-yliminomethyl)-2-iodo-6-methoxyphenol.
Chemical Property Profile of 4-(Azepan-1-yliminomethyl)-2-iodo-6-methoxyphenol
Property Insights of 4-(Azepan-1-yliminomethyl)-2-iodo-6-methoxyphenol
The XLogP value of 3.6 indicates that 4-(Azepan-1-yliminomethyl)-2-iodo-6-methoxyphenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.1 Ų, 4-(Azepan-1-yliminomethyl)-2-iodo-6-methoxyphenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Azepan-1-yliminomethyl)-2-iodo-6-methoxyphenol has 1 hydrogen bond donor(s) and 4 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 4-(Azepan-1-yliminomethyl)-2-iodo-6-methoxyphenol?
The CAS number of 4-(Azepan-1-yliminomethyl)-2-iodo-6-methoxyphenol is 16987-35-2.
What is the molecular formula of 4-(Azepan-1-yliminomethyl)-2-iodo-6-methoxyphenol?
The molecular formula of 4-(Azepan-1-yliminomethyl)-2-iodo-6-methoxyphenol is C14H19IN2O2.
What is the molecular weight of 4-(Azepan-1-yliminomethyl)-2-iodo-6-methoxyphenol?
The molecular weight of 4-(Azepan-1-yliminomethyl)-2-iodo-6-methoxyphenol is 374.05 g/mol.
Where can I buy 4-(Azepan-1-yliminomethyl)-2-iodo-6-methoxyphenol?
You can request a quote for 4-(Azepan-1-yliminomethyl)-2-iodo-6-methoxyphenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(Azepan-1-yliminomethyl)-2-iodo-6-methoxyphenol?
Yes, KEHONG BIO provides custom synthesis services for 4-(Azepan-1-yliminomethyl)-2-iodo-6-methoxyphenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.