1-Methyl-3,5-diphenyl-1,2,5,6-tetrahydro-1,2,4-triazine
TL;DR: 1-Methyl-3,5-diphenyl-1,2,5,6-tetrahydro-1,2,4-triazine (CAS 14079-63-1) is a chemical compound with molecular formula C16H17N3 and molecular weight 251.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-3,5-diphenyl-5,6-dihydro-2H-1,2,4-triazine
Also Known As: 1,4,5,6-Tetrahydro-3,5-diphenyl-1-methyl-as-triazine, as-Triazine, 1,4,5,6-tetrahydro-3,5-diphenyl-1-methyl-, 1-Methyl-3,5-diphenyl-1,2,5,6-tetrahydro-1,2,4-triazine, 1-methyl-3,5-diphenyl-5,6-dihydro-2H-1,2,4-triazine, RefChem:1055772
| Molecular Formula | C16H17N3 |
|---|---|
| Molecular Weight | 251.14 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 27.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 251.14224 |
| Heavy Atoms | 19 |
| Complexity | 314.0 |
Chemical Identifiers
| CAS Number | 14079-63-1 |
|---|---|
| SMILES | CN1CC(N=C(N1)C2=CC=CC=C2)C3=CC=CC=C3 |
| InChIKey | NMVKXWVCWDQWOV-UHFFFAOYSA-N |
Product Overview
1-Methyl-3,5-diphenyl-1,2,5,6-tetrahydro-1,2,4-triazine (CAS 14079-63-1), with molecular formula C16H17N3 and molecular weight 251.14 g/mol. IUPAC: 1-methyl-3,5-diphenyl-5,6-dihydro-2H-1,2,4-triazine.
Chemical Property Profile of 1-Methyl-3,5-diphenyl-1,2,5,6-tetrahydro-1,2,4-triazine
Property Insights of 1-Methyl-3,5-diphenyl-1,2,5,6-tetrahydro-1,2,4-triazine
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Methyl-3,5-diphenyl-1,2,5,6-tetrahydro-1,2,4-triazine. With a topological polar surface area (TPSA) of 27.6 Ų, 1-Methyl-3,5-diphenyl-1,2,5,6-tetrahydro-1,2,4-triazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Methyl-3,5-diphenyl-1,2,5,6-tetrahydro-1,2,4-triazine has 1 hydrogen bond donor(s) and 2 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 1-Methyl-3,5-diphenyl-1,2,5,6-tetrahydro-1,2,4-triazine?
The CAS number of 1-Methyl-3,5-diphenyl-1,2,5,6-tetrahydro-1,2,4-triazine is 14079-63-1.
What is the molecular formula of 1-Methyl-3,5-diphenyl-1,2,5,6-tetrahydro-1,2,4-triazine?
The molecular formula of 1-Methyl-3,5-diphenyl-1,2,5,6-tetrahydro-1,2,4-triazine is C16H17N3.
What is the molecular weight of 1-Methyl-3,5-diphenyl-1,2,5,6-tetrahydro-1,2,4-triazine?
The molecular weight of 1-Methyl-3,5-diphenyl-1,2,5,6-tetrahydro-1,2,4-triazine is 251.14 g/mol.
Where can I buy 1-Methyl-3,5-diphenyl-1,2,5,6-tetrahydro-1,2,4-triazine?
You can request a quote for 1-Methyl-3,5-diphenyl-1,2,5,6-tetrahydro-1,2,4-triazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methyl-3,5-diphenyl-1,2,5,6-tetrahydro-1,2,4-triazine?
Yes, KEHONG BIO provides custom synthesis services for 1-Methyl-3,5-diphenyl-1,2,5,6-tetrahydro-1,2,4-triazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.