5-(4-Methoxyphenyl)-1-phenyl-1,3,5-triazinane-2-thione
TL;DR: 5-(4-Methoxyphenyl)-1-phenyl-1,3,5-triazinane-2-thione (CAS 356773-44-9) is a chemical compound with molecular formula C16H17N3OS and molecular weight 299.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(4-methoxyphenyl)-1-phenyl-1,3,5-triazinane-2-thione
Also Known As: 5-(4-methoxyphenyl)-1-phenyl-1,3,5-triazinane-2-thione
| Molecular Formula | C16H17N3OS |
|---|---|
| Molecular Weight | 299.11 g/mol |
| LogP | 2.8113 |
| Topological Polar Surface Area | 27.74 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 299.10922 |
| Heavy Atoms | 21 |
| Complexity | 615.179 |
Chemical Identifiers
| CAS Number | 356773-44-9 |
|---|---|
| SMILES | COC1=CC=C(C=C1)N2CNC(=S)N(C2)C3=CC=CC=C3 |
Product Overview
5-(4-Methoxyphenyl)-1-phenyl-1,3,5-triazinane-2-thione (CAS 356773-44-9), with molecular formula C16H17N3OS and molecular weight 299.11 g/mol. IUPAC: 5-(4-methoxyphenyl)-1-phenyl-1,3,5-triazinane-2-thione.
Chemical Property Profile of 5-(4-Methoxyphenyl)-1-phenyl-1,3,5-triazinane-2-thione
Property Insights of 5-(4-Methoxyphenyl)-1-phenyl-1,3,5-triazinane-2-thione
The XLogP value of 2.8113 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(4-Methoxyphenyl)-1-phenyl-1,3,5-triazinane-2-thione. With a topological polar surface area (TPSA) of 27.74 Ų, 5-(4-Methoxyphenyl)-1-phenyl-1,3,5-triazinane-2-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(4-Methoxyphenyl)-1-phenyl-1,3,5-triazinane-2-thione 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 5-(4-Methoxyphenyl)-1-phenyl-1,3,5-triazinane-2-thione?
The CAS number of 5-(4-Methoxyphenyl)-1-phenyl-1,3,5-triazinane-2-thione is 356773-44-9.
What is the molecular formula of 5-(4-Methoxyphenyl)-1-phenyl-1,3,5-triazinane-2-thione?
The molecular formula of 5-(4-Methoxyphenyl)-1-phenyl-1,3,5-triazinane-2-thione is C16H17N3OS.
What is the molecular weight of 5-(4-Methoxyphenyl)-1-phenyl-1,3,5-triazinane-2-thione?
The molecular weight of 5-(4-Methoxyphenyl)-1-phenyl-1,3,5-triazinane-2-thione is 299.11 g/mol.
Where can I buy 5-(4-Methoxyphenyl)-1-phenyl-1,3,5-triazinane-2-thione?
You can request a quote for 5-(4-Methoxyphenyl)-1-phenyl-1,3,5-triazinane-2-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(4-Methoxyphenyl)-1-phenyl-1,3,5-triazinane-2-thione?
Yes, KEHONG BIO provides custom synthesis services for 5-(4-Methoxyphenyl)-1-phenyl-1,3,5-triazinane-2-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.