2-amino-N-(1H-1,2,4-triazol-5-yl)benzamide
TL;DR: 2-amino-N-(1H-1,2,4-triazol-5-yl)benzamide (CAS 104035-18-9) is a chemical compound with molecular formula C9H9N5O and molecular weight 203.0807 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-amino-N-(1H-1,2,4-triazol-5-yl)benzamide
Also Known As: 2-amino-N-2H-1,2,4-triazol-3-ylbenzamide, 2-amino-N-(1H-1,2,4-triazol-5-yl)benzamide
Technical Specifications
| Molecular Formula | C9H9N5O |
| Molecular Weight | 203.0807 g/mol |
| XLogP | 1.0 |
| Topological Polar Surface Area (TPSA) | 96.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 203.0807 Da |
| Heavy Atoms | 15 |
| Complexity | 235.0 |
| SMILES | C1=CC=C(C(=C1)C(=O)NC2=NC=NN2)N |
| InChIKey | BQPQEZYJDLGJER-UHFFFAOYSA-N |
Chemical Property Profile of 2-amino-N-(1H-1,2,4-triazol-5-yl)benzamide
Property Insights of 2-amino-N-(1H-1,2,4-triazol-5-yl)benzamide
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-amino-N-(1H-1,2,4-triazol-5-yl)benzamide. The TPSA of 96.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-amino-N-(1H-1,2,4-triazol-5-yl)benzamide. Following Lipinski's Rule of Five, 2-amino-N-(1H-1,2,4-triazol-5-yl)benzamide has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-amino-N-(1H-1,2,4-triazol-5-yl)benzamide?
The CAS number of 2-amino-N-(1H-1,2,4-triazol-5-yl)benzamide is 104035-18-9.
What is the molecular formula of 2-amino-N-(1H-1,2,4-triazol-5-yl)benzamide?
The molecular formula of 2-amino-N-(1H-1,2,4-triazol-5-yl)benzamide is C9H9N5O.
What is the molecular weight of 2-amino-N-(1H-1,2,4-triazol-5-yl)benzamide?
The molecular weight of 2-amino-N-(1H-1,2,4-triazol-5-yl)benzamide is 203.0807 g/mol.
Where can I buy 2-amino-N-(1H-1,2,4-triazol-5-yl)benzamide?
You can request a quote for 2-amino-N-(1H-1,2,4-triazol-5-yl)benzamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-amino-N-(1H-1,2,4-triazol-5-yl)benzamide?
Yes, CoreyChem provides custom synthesis services for 2-amino-N-(1H-1,2,4-triazol-5-yl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.