N-(2-ethylphenyl)-1H-1,2,4-triazole-3-carboxamide
TL;DR: N-(2-ethylphenyl)-1H-1,2,4-triazole-3-carboxamide (CAS 1172847-02-7) is a chemical compound with molecular formula C11H12N4O and molecular weight 216.1011 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(2-ethylphenyl)-1H-1,2,4-triazole-5-carboxamide
Also Known As: 1H-1,2,4-TRIAZOLE-5-CARBOXAMIDE,N-(2-ETHYLPHENYL)-, N-(2-ethylphenyl)-1H-1,2,4-triazole-3-carboxamide, N-(2-ethylphenyl)-1H-1,2,4-triazole-5-carboxamide
Technical Specifications
| Molecular Formula | C11H12N4O |
| Molecular Weight | 216.1011 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 70.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 216.1011 Da |
| Heavy Atoms | 16 |
| Complexity | 246.0 |
| SMILES | CCC1=CC=CC=C1NC(=O)C2=NC=NN2 |
| InChIKey | UBUDFKPFTGXYGV-UHFFFAOYSA-N |
Chemical Property Profile of N-(2-ethylphenyl)-1H-1,2,4-triazole-3-carboxamide
Property Insights of N-(2-ethylphenyl)-1H-1,2,4-triazole-3-carboxamide
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-ethylphenyl)-1H-1,2,4-triazole-3-carboxamide. The TPSA of 70.7 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2-ethylphenyl)-1H-1,2,4-triazole-3-carboxamide. Following Lipinski's Rule of Five, N-(2-ethylphenyl)-1H-1,2,4-triazole-3-carboxamide has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of N-(2-ethylphenyl)-1H-1,2,4-triazole-3-carboxamide?
The CAS number of N-(2-ethylphenyl)-1H-1,2,4-triazole-3-carboxamide is 1172847-02-7.
What is the molecular formula of N-(2-ethylphenyl)-1H-1,2,4-triazole-3-carboxamide?
The molecular formula of N-(2-ethylphenyl)-1H-1,2,4-triazole-3-carboxamide is C11H12N4O.
What is the molecular weight of N-(2-ethylphenyl)-1H-1,2,4-triazole-3-carboxamide?
The molecular weight of N-(2-ethylphenyl)-1H-1,2,4-triazole-3-carboxamide is 216.1011 g/mol.
Where can I buy N-(2-ethylphenyl)-1H-1,2,4-triazole-3-carboxamide?
You can request a quote for N-(2-ethylphenyl)-1H-1,2,4-triazole-3-carboxamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-(2-ethylphenyl)-1H-1,2,4-triazole-3-carboxamide?
Yes, CoreyChem provides custom synthesis services for N-(2-ethylphenyl)-1H-1,2,4-triazole-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.