1-(adamantan-1-yl)-1H-1,2,4-triazol-3-amine
TL;DR: 1-(adamantan-1-yl)-1H-1,2,4-triazol-3-amine (CAS 184219-68-9) is a chemical compound with molecular formula C12H18N4 and molecular weight 218.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1-adamantyl)-1,2,4-triazol-3-amine
Also Known As: 1-(adamantan-1-yl)-1H-1,2,4-triazol-3-amine, 1-(1-adamantyl)-1,2,4-triazol-3-amine, 1-((3s,5s,7s)-adamantan-1-yl)-1H-1,2,4-triazol-3-amine, 1-(1-adamantyl)-1H-1,2,4-triazol-3-amine, J3.286.861D
| Molecular Formula | C12H18N4 |
|---|---|
| Molecular Weight | 218.15 g/mol |
| LogP | 1.7856 |
| Topological Polar Surface Area | 56.73 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 218.15315 |
| Heavy Atoms | 16 |
| Complexity | 387.12396 |
Chemical Identifiers
| CAS Number | 184219-68-9 |
|---|---|
| SMILES | C1C2CC3CC1CC(C2)(C3)N4C=NC(=N4)N |
Product Overview
1-(adamantan-1-yl)-1H-1,2,4-triazol-3-amine (CAS 184219-68-9), with molecular formula C12H18N4 and molecular weight 218.15 g/mol. IUPAC: 1-(1-adamantyl)-1,2,4-triazol-3-amine.
Chemical Property Profile of 1-(adamantan-1-yl)-1H-1,2,4-triazol-3-amine
Property Insights of 1-(adamantan-1-yl)-1H-1,2,4-triazol-3-amine
The XLogP value of 1.7856 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(adamantan-1-yl)-1H-1,2,4-triazol-3-amine. With a topological polar surface area (TPSA) of 56.73 Ų, 1-(adamantan-1-yl)-1H-1,2,4-triazol-3-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(adamantan-1-yl)-1H-1,2,4-triazol-3-amine has 1 hydrogen bond donor(s) and 3 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-(adamantan-1-yl)-1H-1,2,4-triazol-3-amine?
The CAS number of 1-(adamantan-1-yl)-1H-1,2,4-triazol-3-amine is 184219-68-9.
What is the molecular formula of 1-(adamantan-1-yl)-1H-1,2,4-triazol-3-amine?
The molecular formula of 1-(adamantan-1-yl)-1H-1,2,4-triazol-3-amine is C12H18N4.
What is the molecular weight of 1-(adamantan-1-yl)-1H-1,2,4-triazol-3-amine?
The molecular weight of 1-(adamantan-1-yl)-1H-1,2,4-triazol-3-amine is 218.15 g/mol.
Where can I buy 1-(adamantan-1-yl)-1H-1,2,4-triazol-3-amine?
You can request a quote for 1-(adamantan-1-yl)-1H-1,2,4-triazol-3-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(adamantan-1-yl)-1H-1,2,4-triazol-3-amine?
Yes, KEHONG BIO provides custom synthesis services for 1-(adamantan-1-yl)-1H-1,2,4-triazol-3-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.