2-(4-Methoxyphenyl)-4,6-bis(trichloromethyl)-1,3,5-triazine
TL;DR: 2-(4-Methoxyphenyl)-4,6-bis(trichloromethyl)-1,3,5-triazine (CAS 3584-23-4) is a chemical compound with molecular formula C12H7Cl6N3O and molecular weight 418.87 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-methoxyphenyl)-4,6-bis(trichloromethyl)-1,3,5-triazine
Also Known As: 2-(4-Methoxyphenyl)-4,6-bis(trichloromethyl)-1,3,5-triazine, 4,5-Dimethyl-1,3-thiazole, 4486AB, Methoxyphenylbistrichloromethyltriazine, BAS 00537914
| Molecular Formula | C12H7Cl6N3O |
|---|---|
| Molecular Weight | 418.87 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 47.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 420.86908 |
| Heavy Atoms | 22 |
| Complexity | 345.0 |
Chemical Identifiers
| CAS Number | 3584-23-4 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=NC(=NC(=N2)C(Cl)(Cl)Cl)C(Cl)(Cl)Cl |
| InChIKey | QRHHZFRCJDAUNA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(4-Methoxyphenyl)-4,6-bis(trichloromethyl)-1,3,5-triazine (CAS 3584-23-4), with molecular formula C12H7Cl6N3O and molecular weight 418.87 g/mol. IUPAC: 2-(4-methoxyphenyl)-4,6-bis(trichloromethyl)-1,3,5-triazine.
Chemical Property Profile of 2-(4-Methoxyphenyl)-4,6-bis(trichloromethyl)-1,3,5-triazine
Property Insights of 2-(4-Methoxyphenyl)-4,6-bis(trichloromethyl)-1,3,5-triazine
The XLogP value of 4.9 indicates that 2-(4-Methoxyphenyl)-4,6-bis(trichloromethyl)-1,3,5-triazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.9 Ų, 2-(4-Methoxyphenyl)-4,6-bis(trichloromethyl)-1,3,5-triazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Methoxyphenyl)-4,6-bis(trichloromethyl)-1,3,5-triazine has 0 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 2-(4-Methoxyphenyl)-4,6-bis(trichloromethyl)-1,3,5-triazine?
The CAS number of 2-(4-Methoxyphenyl)-4,6-bis(trichloromethyl)-1,3,5-triazine is 3584-23-4.
What is the molecular formula of 2-(4-Methoxyphenyl)-4,6-bis(trichloromethyl)-1,3,5-triazine?
The molecular formula of 2-(4-Methoxyphenyl)-4,6-bis(trichloromethyl)-1,3,5-triazine is C12H7Cl6N3O.
What is the molecular weight of 2-(4-Methoxyphenyl)-4,6-bis(trichloromethyl)-1,3,5-triazine?
The molecular weight of 2-(4-Methoxyphenyl)-4,6-bis(trichloromethyl)-1,3,5-triazine is 418.87 g/mol.
Where can I buy 2-(4-Methoxyphenyl)-4,6-bis(trichloromethyl)-1,3,5-triazine?
You can request a quote for 2-(4-Methoxyphenyl)-4,6-bis(trichloromethyl)-1,3,5-triazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Methoxyphenyl)-4,6-bis(trichloromethyl)-1,3,5-triazine?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Methoxyphenyl)-4,6-bis(trichloromethyl)-1,3,5-triazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.