as-Triazine, 1,4,5,6-tetrahydro-3-phenethyl-
TL;DR: as-Triazine, 1,4,5,6-tetrahydro-3-phenethyl- (CAS 22201-98-5) is a chemical compound with molecular formula C11H15N3 and molecular weight 189.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-phenylethyl)-1,2,5,6-tetrahydro-1,2,4-triazine
Also Known As: as-Triazine, 1,4,5,6-tetrahydro-3-phenethyl-, 3-Phenethyl-1,4,5,6-tetrahydro-as-triazine, 1,4,5,6-Tetrahydro-3-phenethyl-as-triazine, as-Triazine, 3-phenethyl-1,4,5,6-tetrahydro-, 1,4,5,6-Tetrahydro-3-phenethyl-1,2,4-triazine
| Molecular Formula | C11H15N3 |
|---|---|
| Molecular Weight | 189.13 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 36.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 189.1266 |
| Heavy Atoms | 14 |
| Complexity | 195.0 |
Chemical Identifiers
| CAS Number | 22201-98-5 |
|---|---|
| SMILES | C1CN=C(NN1)CCC2=CC=CC=C2 |
| InChIKey | INIBGFCGSJWQJE-UHFFFAOYSA-N |
Product Overview
as-Triazine, 1,4,5,6-tetrahydro-3-phenethyl- (CAS 22201-98-5), with molecular formula C11H15N3 and molecular weight 189.13 g/mol. IUPAC: 3-(2-phenylethyl)-1,2,5,6-tetrahydro-1,2,4-triazine.
Chemical Property Profile of as-Triazine, 1,4,5,6-tetrahydro-3-phenethyl-
Property Insights of as-Triazine, 1,4,5,6-tetrahydro-3-phenethyl-
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for as-Triazine, 1,4,5,6-tetrahydro-3-phenethyl-. With a topological polar surface area (TPSA) of 36.4 Ų, as-Triazine, 1,4,5,6-tetrahydro-3-phenethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, as-Triazine, 1,4,5,6-tetrahydro-3-phenethyl- 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-3-phenethyl-?
The CAS number of as-Triazine, 1,4,5,6-tetrahydro-3-phenethyl- is 22201-98-5.
What is the molecular formula of as-Triazine, 1,4,5,6-tetrahydro-3-phenethyl-?
The molecular formula of as-Triazine, 1,4,5,6-tetrahydro-3-phenethyl- is C11H15N3.
What is the molecular weight of as-Triazine, 1,4,5,6-tetrahydro-3-phenethyl-?
The molecular weight of as-Triazine, 1,4,5,6-tetrahydro-3-phenethyl- is 189.13 g/mol.
Where can I buy as-Triazine, 1,4,5,6-tetrahydro-3-phenethyl-?
You can request a quote for as-Triazine, 1,4,5,6-tetrahydro-3-phenethyl- 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-3-phenethyl-?
Yes, KEHONG BIO provides custom synthesis services for as-Triazine, 1,4,5,6-tetrahydro-3-phenethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.