![(5E)-5-[(4-butan-2-yloxy-3-chlorophenyl)methylidene]-1-(2,4-dimethylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione structure](/static/products/690/690669-79-5.png)
(5E)-5-[(4-butan-2-yloxy-3-chlorophenyl)methylidene]-1-(2,4-dimethylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
TL;DR: (5E)-5-[(4-butan-2-yloxy-3-chlorophenyl)methylidene]-1-(2,4-dimethylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione (CAS 690669-79-5) is a chemical compound with molecular formula C23H23ClN2O3S and molecular weight 442.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-5-[(4-butan-2-yloxy-3-chlorophenyl)methylidene]-1-(2,4-dimethylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
Also Known As: (5E)-5-[(4-butan-2-yloxy-3-chlorophenyl)methylidene]-1-(2,4-dimethylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione, (5E)-5-[4-(butan-2-yloxy)-3-chlorobenzylidene]-1-(2,4-dimethylphenyl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
| Molecular Formula | C23H23ClN2O3S |
|---|---|
| Molecular Weight | 442.11 g/mol |
| LogP | 4.96544 |
| Topological Polar Surface Area | 58.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 442.1118 |
| Heavy Atoms | 30 |
| Complexity | 1064.4089 |
Chemical Identifiers
| CAS Number | 690669-79-5 |
|---|---|
| SMILES | CCC(C)OC1=C(C=C(C=C1)/C=C/2\C(=O)NC(=S)N(C2=O)C3=C(C=C(C=C3)C)C)Cl |
Product Overview
(5E)-5-[(4-butan-2-yloxy-3-chlorophenyl)methylidene]-1-(2,4-dimethylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione (CAS 690669-79-5), with molecular formula C23H23ClN2O3S and molecular weight 442.11 g/mol. IUPAC: (5E)-5-[(4-butan-2-yloxy-3-chlorophenyl)methylidene]-1-(2,4-dimethylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione.
Chemical Property Profile of (5E)-5-[(4-butan-2-yloxy-3-chlorophenyl)methylidene]-1-(2,4-dimethylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
Property Insights of (5E)-5-[(4-butan-2-yloxy-3-chlorophenyl)methylidene]-1-(2,4-dimethylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
The XLogP value of 4.96544 indicates that (5E)-5-[(4-butan-2-yloxy-3-chlorophenyl)methylidene]-1-(2,4-dimethylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.64 Ų, (5E)-5-[(4-butan-2-yloxy-3-chlorophenyl)methylidene]-1-(2,4-dimethylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (5E)-5-[(4-butan-2-yloxy-3-chlorophenyl)methylidene]-1-(2,4-dimethylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione 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 (5E)-5-[(4-butan-2-yloxy-3-chlorophenyl)methylidene]-1-(2,4-dimethylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione?
The CAS number of (5E)-5-[(4-butan-2-yloxy-3-chlorophenyl)methylidene]-1-(2,4-dimethylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione is 690669-79-5.
What is the molecular formula of (5E)-5-[(4-butan-2-yloxy-3-chlorophenyl)methylidene]-1-(2,4-dimethylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione?
The molecular formula of (5E)-5-[(4-butan-2-yloxy-3-chlorophenyl)methylidene]-1-(2,4-dimethylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione is C23H23ClN2O3S.
What is the molecular weight of (5E)-5-[(4-butan-2-yloxy-3-chlorophenyl)methylidene]-1-(2,4-dimethylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione?
The molecular weight of (5E)-5-[(4-butan-2-yloxy-3-chlorophenyl)methylidene]-1-(2,4-dimethylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione is 442.11 g/mol.
Where can I buy (5E)-5-[(4-butan-2-yloxy-3-chlorophenyl)methylidene]-1-(2,4-dimethylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione?
You can request a quote for (5E)-5-[(4-butan-2-yloxy-3-chlorophenyl)methylidene]-1-(2,4-dimethylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (5E)-5-[(4-butan-2-yloxy-3-chlorophenyl)methylidene]-1-(2,4-dimethylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione?
Yes, KEHONG BIO provides custom synthesis services for (5E)-5-[(4-butan-2-yloxy-3-chlorophenyl)methylidene]-1-(2,4-dimethylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.