AB00118844-01
TL;DR: AB00118844-01 (CAS 431979-58-7) is a chemical compound with molecular formula C20H19ClN2O5 and molecular weight 402.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-3-[(4-chlorophenyl)methyl]-5-[(2,4,5-trimethoxyphenyl)methylidene]imidazolidine-2,4-dione
Also Known As: AB00118844-01, (5Z)-3-[(4-chlorophenyl)methyl]-5-[(2,4,5-trimethoxyphenyl)methylidene]imidazolidine-2,4-dione, (5Z)-3-(4-chlorobenzyl)-5-(2,4,5-trimethoxybenzylidene)imidazolidine-2,4-dione, 3-(4-chlorobenzyl)-5-(2,4,5-trimethoxybenzylidene)-2,4-imidazolidinedione, 3-[(4-chlorophenyl)methyl]-5-[(2,4,5-trimethoxyphenyl)methylene]-1,3-diazolidi ne-2,4-dione
| Molecular Formula | C20H19ClN2O5 |
|---|---|
| Molecular Weight | 402.10 g/mol |
| LogP | 3.4587 |
| Topological Polar Surface Area | 77.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 402.09824 |
| Heavy Atoms | 28 |
| Complexity | 940.35736 |
Chemical Identifiers
| CAS Number | 431979-58-7 |
|---|---|
| SMILES | COC1=CC(=C(C=C1/C=C\2/C(=O)N(C(=O)N2)CC3=CC=C(C=C3)Cl)OC)OC |
Product Overview
AB00118844-01 (CAS 431979-58-7), with molecular formula C20H19ClN2O5 and molecular weight 402.10 g/mol. IUPAC: (5Z)-3-[(4-chlorophenyl)methyl]-5-[(2,4,5-trimethoxyphenyl)methylidene]imidazolidine-2,4-dione.
Chemical Property Profile of AB00118844-01
Property Insights of AB00118844-01
The XLogP value of 3.4587 indicates that AB00118844-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.1 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00118844-01. Following Lipinski's Rule of Five, AB00118844-01 has 1 hydrogen bond donor(s) and 5 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 AB00118844-01?
The CAS number of AB00118844-01 is 431979-58-7.
What is the molecular formula of AB00118844-01?
The molecular formula of AB00118844-01 is C20H19ClN2O5.
What is the molecular weight of AB00118844-01?
The molecular weight of AB00118844-01 is 402.10 g/mol.
Where can I buy AB00118844-01?
You can request a quote for AB00118844-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00118844-01?
Yes, KEHONG BIO provides custom synthesis services for AB00118844-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.