AB00116949-01
TL;DR: AB00116949-01 (CAS 431929-68-9) is a chemical compound with molecular formula C21H20Cl2N2O4 and molecular weight 434.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-5-[(3-chloro-4,5-diethoxyphenyl)methylidene]-3-[(4-chlorophenyl)methyl]imidazolidine-2,4-dione
Also Known As: AB00116949-01, (5Z)-5-[(3-chloro-4,5-diethoxyphenyl)methylidene]-3-[(4-chlorophenyl)methyl]imidazolidine-2,4-dione, (5Z)-3-(4-chlorobenzyl)-5-(3-chloro-4,5-diethoxybenzylidene)imidazolidine-2,4-dione, 3-(4-chlorobenzyl)-5-(3-chloro-4,5-diethoxybenzylidene)-2,4-imidazolidinedione
| Molecular Formula | C21H20Cl2N2O4 |
|---|---|
| Molecular Weight | 434.08 g/mol |
| LogP | 4.8837 |
| Topological Polar Surface Area | 67.87 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 434.08002 |
| Heavy Atoms | 29 |
| Complexity | 957.8986 |
Chemical Identifiers
| CAS Number | 431929-68-9 |
|---|---|
| SMILES | CCOC1=C(C(=CC(=C1)/C=C\2/C(=O)N(C(=O)N2)CC3=CC=C(C=C3)Cl)Cl)OCC |
Product Overview
AB00116949-01 (CAS 431929-68-9), with molecular formula C21H20Cl2N2O4 and molecular weight 434.08 g/mol. IUPAC: (5Z)-5-[(3-chloro-4,5-diethoxyphenyl)methylidene]-3-[(4-chlorophenyl)methyl]imidazolidine-2,4-dione.
Chemical Property Profile of AB00116949-01
Property Insights of AB00116949-01
The XLogP value of 4.8837 indicates that AB00116949-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.87 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00116949-01. Following Lipinski's Rule of Five, AB00116949-01 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 AB00116949-01?
The CAS number of AB00116949-01 is 431929-68-9.
What is the molecular formula of AB00116949-01?
The molecular formula of AB00116949-01 is C21H20Cl2N2O4.
What is the molecular weight of AB00116949-01?
The molecular weight of AB00116949-01 is 434.08 g/mol.
Where can I buy AB00116949-01?
You can request a quote for AB00116949-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00116949-01?
Yes, KEHONG BIO provides custom synthesis services for AB00116949-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.