AN-989/40746619
TL;DR: AN-989/40746619 (CAS 428856-99-9) is a chemical compound with molecular formula C21H22N2O2S and molecular weight 366.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-5-[(4-methoxy-2-methyl-5-propan-2-ylphenyl)methylidene]-3-phenyl-2-sulfanylideneimidazolidin-4-one
Also Known As: AN-989/40746619, 5-(5-isopropyl-4-methoxy-2-methylbenzylidene)-3-phenyl-2-thioxo-4-imidazolidinone, (5Z)-5-[(4-methoxy-2-methyl-5-propan-2-ylphenyl)methylidene]-3-phenyl-2-sulfanylideneimidazolidin-4-one
| Molecular Formula | C21H22N2O2S |
|---|---|
| Molecular Weight | 366.14 g/mol |
| LogP | 4.38922 |
| Topological Polar Surface Area | 41.57 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 366.1402 |
| Heavy Atoms | 26 |
| Complexity | 888.38416 |
Chemical Identifiers
| CAS Number | 428856-99-9 |
|---|---|
| SMILES | CC1=CC(=C(C=C1/C=C\2/C(=O)N(C(=S)N2)C3=CC=CC=C3)C(C)C)OC |
Product Overview
AN-989/40746619 (CAS 428856-99-9), with molecular formula C21H22N2O2S and molecular weight 366.14 g/mol. IUPAC: (5Z)-5-[(4-methoxy-2-methyl-5-propan-2-ylphenyl)methylidene]-3-phenyl-2-sulfanylideneimidazolidin-4-one.
Chemical Property Profile of AN-989/40746619
Property Insights of AN-989/40746619
The XLogP value of 4.38922 indicates that AN-989/40746619 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.57 Ų, AN-989/40746619 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AN-989/40746619 has 1 hydrogen bond donor(s) and 3 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 AN-989/40746619?
The CAS number of AN-989/40746619 is 428856-99-9.
What is the molecular formula of AN-989/40746619?
The molecular formula of AN-989/40746619 is C21H22N2O2S.
What is the molecular weight of AN-989/40746619?
The molecular weight of AN-989/40746619 is 366.14 g/mol.
Where can I buy AN-989/40746619?
You can request a quote for AN-989/40746619 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-989/40746619?
Yes, KEHONG BIO provides custom synthesis services for AN-989/40746619 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.