![3-Benzyl-5-(4,5-dihydro-oxazol-2-yl)-3H-[1,2,3]triazol-4-ylamine structure](/static/products/1265/126537-90-4.webp)
3-Benzyl-5-(4,5-dihydro-oxazol-2-yl)-3H-[1,2,3]triazol-4-ylamine
TL;DR: 3-Benzyl-5-(4,5-dihydro-oxazol-2-yl)-3H-[1,2,3]triazol-4-ylamine (CAS 126537-90-4) is a chemical compound with molecular formula C12H13N5O and molecular weight 243.11201 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-benzyl-5-(4,5-dihydro-1,3-oxazol-2-yl)triazol-4-amine
Also Known As: BAS 01861881, 3-Benzyl-5-(4,5-dihydro-oxazol-2-yl)-3H-[1,2,3]triazol-4-ylamine, [3-benzyl-5-(2-oxazolin-2-yl)triazol-4-yl]amine, 3-benzyl-5-(4,5-dihydro-1,3-oxazol-2-yl)triazol-4-amine, 1-Benzyl-4-(4,5-dihydro-1,3-oxazol-2-yl)-1H-1,2,3-triazol-5-amine
Technical Specifications
| Molecular Formula | C12H13N5O |
| Molecular Weight | 243.11201 g/mol |
| XLogP | 0.8 |
| Topological Polar Surface Area (TPSA) | 78.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 243.11201 Da |
| Heavy Atoms | 18 |
| Complexity | 316.0 |
| SMILES | C1COC(=N1)C2=C(N(N=N2)CC3=CC=CC=C3)N |
| InChIKey | OEABJCWBQDFEHZ-UHFFFAOYSA-N |
Chemical Property Profile of 3-Benzyl-5-(4,5-dihydro-oxazol-2-yl)-3H-[1,2,3]triazol-4-ylamine
Property Insights of 3-Benzyl-5-(4,5-dihydro-oxazol-2-yl)-3H-[1,2,3]triazol-4-ylamine
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Benzyl-5-(4,5-dihydro-oxazol-2-yl)-3H-[1,2,3]triazol-4-ylamine. The TPSA of 78.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Benzyl-5-(4,5-dihydro-oxazol-2-yl)-3H-[1,2,3]triazol-4-ylamine. Following Lipinski's Rule of Five, 3-Benzyl-5-(4,5-dihydro-oxazol-2-yl)-3H-[1,2,3]triazol-4-ylamine has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-Benzyl-5-(4,5-dihydro-oxazol-2-yl)-3H-[1,2,3]triazol-4-ylamine?
The CAS number of 3-Benzyl-5-(4,5-dihydro-oxazol-2-yl)-3H-[1,2,3]triazol-4-ylamine is 126537-90-4.
What is the molecular formula of 3-Benzyl-5-(4,5-dihydro-oxazol-2-yl)-3H-[1,2,3]triazol-4-ylamine?
The molecular formula of 3-Benzyl-5-(4,5-dihydro-oxazol-2-yl)-3H-[1,2,3]triazol-4-ylamine is C12H13N5O.
What is the molecular weight of 3-Benzyl-5-(4,5-dihydro-oxazol-2-yl)-3H-[1,2,3]triazol-4-ylamine?
The molecular weight of 3-Benzyl-5-(4,5-dihydro-oxazol-2-yl)-3H-[1,2,3]triazol-4-ylamine is 243.11201 g/mol.
Where can I buy 3-Benzyl-5-(4,5-dihydro-oxazol-2-yl)-3H-[1,2,3]triazol-4-ylamine?
You can request a quote for 3-Benzyl-5-(4,5-dihydro-oxazol-2-yl)-3H-[1,2,3]triazol-4-ylamine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-Benzyl-5-(4,5-dihydro-oxazol-2-yl)-3H-[1,2,3]triazol-4-ylamine?
Yes, CoreyChem provides custom synthesis services for 3-Benzyl-5-(4,5-dihydro-oxazol-2-yl)-3H-[1,2,3]triazol-4-ylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.