Methyl 5-methoxy-3-(4-methylphenyl)-1,2,4-triazine-6-carboxylate
TL;DR: Methyl 5-methoxy-3-(4-methylphenyl)-1,2,4-triazine-6-carboxylate (CAS 126542-67-4) is a chemical compound with molecular formula C13H13N3O3 and molecular weight 259.0957 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 5-methoxy-3-(4-methylphenyl)-1,2,4-triazine-6-carboxylate
Also Known As: Methyl 5-methoxy-3-(4-methylphenyl)-1,2,4-triazine-6-carboxylate, 6K-616S, Methyl5-methoxy-3-(4-methylphenyl)-1,2,4-triazine-6-carboxylate
Technical Specifications
| Molecular Formula | C13H13N3O3 |
| Molecular Weight | 259.0957 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 74.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 259.0957 Da |
| Heavy Atoms | 19 |
| Complexity | 306.0 |
| SMILES | CC1=CC=C(C=C1)C2=NC(=C(N=N2)C(=O)OC)OC |
| InChIKey | YZCFCUXTDSAIDU-UHFFFAOYSA-N |
Chemical Property Profile of Methyl 5-methoxy-3-(4-methylphenyl)-1,2,4-triazine-6-carboxylate
Property Insights of Methyl 5-methoxy-3-(4-methylphenyl)-1,2,4-triazine-6-carboxylate
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 5-methoxy-3-(4-methylphenyl)-1,2,4-triazine-6-carboxylate. The TPSA of 74.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 5-methoxy-3-(4-methylphenyl)-1,2,4-triazine-6-carboxylate. Following Lipinski's Rule of Five, Methyl 5-methoxy-3-(4-methylphenyl)-1,2,4-triazine-6-carboxylate has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Methyl 5-methoxy-3-(4-methylphenyl)-1,2,4-triazine-6-carboxylate?
The CAS number of Methyl 5-methoxy-3-(4-methylphenyl)-1,2,4-triazine-6-carboxylate is 126542-67-4.
What is the molecular formula of Methyl 5-methoxy-3-(4-methylphenyl)-1,2,4-triazine-6-carboxylate?
The molecular formula of Methyl 5-methoxy-3-(4-methylphenyl)-1,2,4-triazine-6-carboxylate is C13H13N3O3.
What is the molecular weight of Methyl 5-methoxy-3-(4-methylphenyl)-1,2,4-triazine-6-carboxylate?
The molecular weight of Methyl 5-methoxy-3-(4-methylphenyl)-1,2,4-triazine-6-carboxylate is 259.0957 g/mol.
Where can I buy Methyl 5-methoxy-3-(4-methylphenyl)-1,2,4-triazine-6-carboxylate?
You can request a quote for Methyl 5-methoxy-3-(4-methylphenyl)-1,2,4-triazine-6-carboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methyl 5-methoxy-3-(4-methylphenyl)-1,2,4-triazine-6-carboxylate?
Yes, CoreyChem provides custom synthesis services for Methyl 5-methoxy-3-(4-methylphenyl)-1,2,4-triazine-6-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.