AB00103886-01
TL;DR: AB00103886-01 (CAS 425607-63-2) is a chemical compound with molecular formula C18H17IN4O3 and molecular weight 464.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-1-[3-iodo-5-methoxy-4-(2-phenoxyethoxy)phenyl]-N-(1,2,4-triazol-4-yl)methanimine
Also Known As: AB00103886-01, N-{(E)-[3-iodo-5-methoxy-4-(2-phenoxyethoxy)phenyl]methylidene}-4H-1,2,4-triazol-4-amine, (E)-1-[3-iodo-5-methoxy-4-(2-phenoxyethoxy)phenyl]-N-(1,2,4-triazol-4-yl)methanimine, 1-[3-iodo-5-methoxy-4-(2-phenoxyethoxy)phenyl]-N-(1,2,4-triazol-4-yl)methanimine
| Molecular Formula | C18H17IN4O3 |
|---|---|
| Molecular Weight | 464.03 g/mol |
| LogP | 3.2313 |
| Topological Polar Surface Area | 70.76 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 464.03455 |
| Heavy Atoms | 26 |
| Complexity | 854.38257 |
Chemical Identifiers
| CAS Number | 425607-63-2 |
|---|---|
| SMILES | COC1=C(C(=CC(=C1)/C=N/N2C=NN=C2)I)OCCOC3=CC=CC=C3 |
Product Overview
AB00103886-01 (CAS 425607-63-2), with molecular formula C18H17IN4O3 and molecular weight 464.03 g/mol. IUPAC: (E)-1-[3-iodo-5-methoxy-4-(2-phenoxyethoxy)phenyl]-N-(1,2,4-triazol-4-yl)methanimine.
Chemical Property Profile of AB00103886-01
Property Insights of AB00103886-01
The XLogP value of 3.2313 indicates that AB00103886-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.76 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00103886-01. Following Lipinski's Rule of Five, AB00103886-01 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 AB00103886-01?
The CAS number of AB00103886-01 is 425607-63-2.
What is the molecular formula of AB00103886-01?
The molecular formula of AB00103886-01 is C18H17IN4O3.
What is the molecular weight of AB00103886-01?
The molecular weight of AB00103886-01 is 464.03 g/mol.
Where can I buy AB00103886-01?
You can request a quote for AB00103886-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00103886-01?
Yes, KEHONG BIO provides custom synthesis services for AB00103886-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.