3-(Isobutylthio)-5,6-diphenyl-1,2,4-triazine
TL;DR: 3-(Isobutylthio)-5,6-diphenyl-1,2,4-triazine (CAS 353479-43-3) is a chemical compound with molecular formula C19H19N3S and molecular weight 321.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-methylpropylsulfanyl)-5,6-diphenyl-1,2,4-triazine
Also Known As: starbld0027512, 3-(isobutylthio)-5,6-diphenyl-1,2,4-triazine, 3-(isobutylsulfanyl)-5,6-diphenyl-1,2,4-triazine, 3-[(2-METHYLPROPYL)SULFANYL]-5,6-DIPHENYL-1,2,4-TRIAZINE, 3-(2-methylpropylsulfanyl)-5,6-diphenyl-1,2,4-triazine
| Molecular Formula | C19H19N3S |
|---|---|
| Molecular Weight | 321.13 g/mol |
| LogP | 4.9537 |
| Topological Polar Surface Area | 38.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 321.12997 |
| Heavy Atoms | 23 |
| Complexity | 758.0832 |
Chemical Identifiers
| CAS Number | 353479-43-3 |
|---|---|
| SMILES | CC(C)CSC1=NC(=C(N=N1)C2=CC=CC=C2)C3=CC=CC=C3 |
Product Overview
3-(Isobutylthio)-5,6-diphenyl-1,2,4-triazine (CAS 353479-43-3), with molecular formula C19H19N3S and molecular weight 321.13 g/mol. IUPAC: 3-(2-methylpropylsulfanyl)-5,6-diphenyl-1,2,4-triazine.
Chemical Property Profile of 3-(Isobutylthio)-5,6-diphenyl-1,2,4-triazine
Property Insights of 3-(Isobutylthio)-5,6-diphenyl-1,2,4-triazine
The XLogP value of 4.9537 indicates that 3-(Isobutylthio)-5,6-diphenyl-1,2,4-triazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.67 Ų, 3-(Isobutylthio)-5,6-diphenyl-1,2,4-triazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Isobutylthio)-5,6-diphenyl-1,2,4-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 3-(Isobutylthio)-5,6-diphenyl-1,2,4-triazine?
The CAS number of 3-(Isobutylthio)-5,6-diphenyl-1,2,4-triazine is 353479-43-3.
What is the molecular formula of 3-(Isobutylthio)-5,6-diphenyl-1,2,4-triazine?
The molecular formula of 3-(Isobutylthio)-5,6-diphenyl-1,2,4-triazine is C19H19N3S.
What is the molecular weight of 3-(Isobutylthio)-5,6-diphenyl-1,2,4-triazine?
The molecular weight of 3-(Isobutylthio)-5,6-diphenyl-1,2,4-triazine is 321.13 g/mol.
Where can I buy 3-(Isobutylthio)-5,6-diphenyl-1,2,4-triazine?
You can request a quote for 3-(Isobutylthio)-5,6-diphenyl-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 3-(Isobutylthio)-5,6-diphenyl-1,2,4-triazine?
Yes, KEHONG BIO provides custom synthesis services for 3-(Isobutylthio)-5,6-diphenyl-1,2,4-triazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.