1H-1,2,4-Triazol-3-amine, 1-(1-oxononyl)-
TL;DR: 1H-1,2,4-Triazol-3-amine, 1-(1-oxononyl)- (CAS 114804-91-0) is a chemical compound with molecular formula C11H20N4O and molecular weight 224.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-amino-1,2,4-triazol-1-yl)nonan-1-one
Also Known As: 1H-1,2,4-Triazol-3-amine, 1-(1-oxononyl)-, 1-(3-amino-1,2,4-triazol-1-yl)nonan-1-one, 1-(3-Amino-1H-1,2,4-triazol-1-yl)nonan-1-one
| Molecular Formula | C11H20N4O |
|---|---|
| Molecular Weight | 224.16 g/mol |
| LogP | 2.2511 |
| Topological Polar Surface Area | 73.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 224.16371 |
| Heavy Atoms | 16 |
| Complexity | 321.5394 |
Chemical Identifiers
| CAS Number | 114804-91-0 |
|---|---|
| SMILES | CCCCCCCCC(=O)N1C=NC(=N1)N |
Product Overview
1H-1,2,4-Triazol-3-amine, 1-(1-oxononyl)- (CAS 114804-91-0), with molecular formula C11H20N4O and molecular weight 224.16 g/mol. IUPAC: 1-(3-amino-1,2,4-triazol-1-yl)nonan-1-one.
Chemical Property Profile of 1H-1,2,4-Triazol-3-amine, 1-(1-oxononyl)-
Property Insights of 1H-1,2,4-Triazol-3-amine, 1-(1-oxononyl)-
The XLogP value of 2.2511 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-1,2,4-Triazol-3-amine, 1-(1-oxononyl)-. The TPSA of 73.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-1,2,4-Triazol-3-amine, 1-(1-oxononyl)-. Following Lipinski's Rule of Five, 1H-1,2,4-Triazol-3-amine, 1-(1-oxononyl)- has 1 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 1H-1,2,4-Triazol-3-amine, 1-(1-oxononyl)-?
The CAS number of 1H-1,2,4-Triazol-3-amine, 1-(1-oxononyl)- is 114804-91-0.
What is the molecular formula of 1H-1,2,4-Triazol-3-amine, 1-(1-oxononyl)-?
The molecular formula of 1H-1,2,4-Triazol-3-amine, 1-(1-oxononyl)- is C11H20N4O.
What is the molecular weight of 1H-1,2,4-Triazol-3-amine, 1-(1-oxononyl)-?
The molecular weight of 1H-1,2,4-Triazol-3-amine, 1-(1-oxononyl)- is 224.16 g/mol.
Where can I buy 1H-1,2,4-Triazol-3-amine, 1-(1-oxononyl)-?
You can request a quote for 1H-1,2,4-Triazol-3-amine, 1-(1-oxononyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-1,2,4-Triazol-3-amine, 1-(1-oxononyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1H-1,2,4-Triazol-3-amine, 1-(1-oxononyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.