AB00116796-01
TL;DR: AB00116796-01 (CAS 431930-35-7) is a chemical compound with molecular formula C18H14ClIN2O4 and molecular weight 483.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-5-[[4-[(4-chlorophenyl)methoxy]-3-iodo-5-methoxyphenyl]methylidene]imidazolidine-2,4-dione
Also Known As: AB00116796-01, (5Z)-5-{4-[(4-chlorobenzyl)oxy]-3-iodo-5-methoxybenzylidene}imidazolidine-2,4-dione, (5Z)-5-[[4-[(4-chlorophenyl)methoxy]-3-iodo-5-methoxyphenyl]methylidene]imidazolidine-2,4-dione, 5-{4-[(4-chlorobenzyl)oxy]-3-iodo-5-methoxybenzylidene}-2,4-imidazolidinedione
| Molecular Formula | C18H14ClIN2O4 |
|---|---|
| Molecular Weight | 483.97 g/mol |
| LogP | 3.7125 |
| Topological Polar Surface Area | 76.66 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 483.9687 |
| Heavy Atoms | 26 |
| Complexity | 896.80927 |
Chemical Identifiers
| CAS Number | 431930-35-7 |
|---|---|
| SMILES | COC1=C(C(=CC(=C1)/C=C\2/C(=O)NC(=O)N2)I)OCC3=CC=C(C=C3)Cl |
Product Overview
AB00116796-01 (CAS 431930-35-7), with molecular formula C18H14ClIN2O4 and molecular weight 483.97 g/mol. IUPAC: (5Z)-5-[[4-[(4-chlorophenyl)methoxy]-3-iodo-5-methoxyphenyl]methylidene]imidazolidine-2,4-dione.
Chemical Property Profile of AB00116796-01
Property Insights of AB00116796-01
The XLogP value of 3.7125 indicates that AB00116796-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.66 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00116796-01. Following Lipinski's Rule of Five, AB00116796-01 has 2 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 AB00116796-01?
The CAS number of AB00116796-01 is 431930-35-7.
What is the molecular formula of AB00116796-01?
The molecular formula of AB00116796-01 is C18H14ClIN2O4.
What is the molecular weight of AB00116796-01?
The molecular weight of AB00116796-01 is 483.97 g/mol.
Where can I buy AB00116796-01?
You can request a quote for AB00116796-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00116796-01?
Yes, KEHONG BIO provides custom synthesis services for AB00116796-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.