as-Triazine, 1,4,5,6-tetrahydro-1-methyl-3-phenethyl-, hydrochloride
TL;DR: as-Triazine, 1,4,5,6-tetrahydro-1-methyl-3-phenethyl-, hydrochloride (CAS 22201-99-6) is a chemical compound with molecular formula C12H18ClN3 and molecular weight 239.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-3-(2-phenylethyl)-5,6-dihydro-2H-1,2,4-triazine;hydrochloride
Also Known As: as-Triazine, 1,4,5,6-tetrahydro-1-methyl-3-phenethyl-, hydrochloride, 1,4,5,6-Tetrahydro-1-methyl-3-phenethyl-as-triazine hydrochloride, 1-Methyl-3-phenethyl-1,4,5,6-tetrahydro-as-triazine hydrochloride, as-Triazine, 1-methyl-3-phenethyl-1,4,5,6-tetrahydro-, hydrochloride, 1-methyl-3-phenethyl-5,6-dihydro-2H-1,2,4-triazine hydrochloride
| Molecular Formula | C12H18ClN3 |
|---|---|
| Molecular Weight | 239.12 g/mol |
| LogP | 1.89 |
| Topological Polar Surface Area | 27.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 239.11893 |
| Heavy Atoms | 16 |
| Complexity | 219.0 |
Chemical Identifiers
| CAS Number | 22201-99-6 |
|---|---|
| SMILES | CN1CCN=C(N1)CCC2=CC=CC=C2.Cl |
| InChIKey | VASJERGNIVJDEM-UHFFFAOYSA-N |
Product Overview
as-Triazine, 1,4,5,6-tetrahydro-1-methyl-3-phenethyl-, hydrochloride (CAS 22201-99-6), with molecular formula C12H18ClN3 and molecular weight 239.12 g/mol. IUPAC: 1-methyl-3-(2-phenylethyl)-5,6-dihydro-2H-1,2,4-triazine;hydrochloride.
Chemical Property Profile of as-Triazine, 1,4,5,6-tetrahydro-1-methyl-3-phenethyl-, hydrochloride
Property Insights of as-Triazine, 1,4,5,6-tetrahydro-1-methyl-3-phenethyl-, hydrochloride
The XLogP value of 1.89 suggests moderate lipophilicity, balancing water solubility and membrane permeability for as-Triazine, 1,4,5,6-tetrahydro-1-methyl-3-phenethyl-, hydrochloride. With a topological polar surface area (TPSA) of 27.6 Ų, as-Triazine, 1,4,5,6-tetrahydro-1-methyl-3-phenethyl-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, as-Triazine, 1,4,5,6-tetrahydro-1-methyl-3-phenethyl-, hydrochloride has 2 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 as-Triazine, 1,4,5,6-tetrahydro-1-methyl-3-phenethyl-, hydrochloride?
The CAS number of as-Triazine, 1,4,5,6-tetrahydro-1-methyl-3-phenethyl-, hydrochloride is 22201-99-6.
What is the molecular formula of as-Triazine, 1,4,5,6-tetrahydro-1-methyl-3-phenethyl-, hydrochloride?
The molecular formula of as-Triazine, 1,4,5,6-tetrahydro-1-methyl-3-phenethyl-, hydrochloride is C12H18ClN3.
What is the molecular weight of as-Triazine, 1,4,5,6-tetrahydro-1-methyl-3-phenethyl-, hydrochloride?
The molecular weight of as-Triazine, 1,4,5,6-tetrahydro-1-methyl-3-phenethyl-, hydrochloride is 239.12 g/mol.
Where can I buy as-Triazine, 1,4,5,6-tetrahydro-1-methyl-3-phenethyl-, hydrochloride?
You can request a quote for as-Triazine, 1,4,5,6-tetrahydro-1-methyl-3-phenethyl-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for as-Triazine, 1,4,5,6-tetrahydro-1-methyl-3-phenethyl-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for as-Triazine, 1,4,5,6-tetrahydro-1-methyl-3-phenethyl-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.