![N-[(3-amino-1H-1,2,4-triazol-5-yl)methyl]benzamide structure](/static/products/110/110181-51-6.webp)
N-[(3-amino-1H-1,2,4-triazol-5-yl)methyl]benzamide
TL;DR: N-[(3-amino-1H-1,2,4-triazol-5-yl)methyl]benzamide (CAS 110181-51-6) is a chemical compound with molecular formula C10H11N5O and molecular weight 217.09636 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[(3-amino-1H-1,2,4-triazol-5-yl)methyl]benzamide
Also Known As: N-[(3-amino-1H-1,2,4-triazol-5-yl)methyl]benzamide, IDI1_028836, N-((3-Amino-1H-1,2,4-triazol-5-yl)methyl)benzamide, N-(5-amino-1H-[1,2,4]triazol-3-ylmethyl)-benzamide, benzamide, N-[(3-amino-1H-1,2,4-triazol-5-yl)methyl]-
Technical Specifications
| Molecular Formula | C10H11N5O |
| Molecular Weight | 217.09636 g/mol |
| XLogP | 0.4 |
| Topological Polar Surface Area (TPSA) | 96.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 217.09636 Da |
| Heavy Atoms | 16 |
| Complexity | 241.0 |
| SMILES | C1=CC=C(C=C1)C(=O)NCC2=NC(=NN2)N |
| InChIKey | IELRWQHVUYEFSM-UHFFFAOYSA-N |
Chemical Property Profile of N-[(3-amino-1H-1,2,4-triazol-5-yl)methyl]benzamide
Property Insights of N-[(3-amino-1H-1,2,4-triazol-5-yl)methyl]benzamide
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(3-amino-1H-1,2,4-triazol-5-yl)methyl]benzamide. The TPSA of 96.7 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(3-amino-1H-1,2,4-triazol-5-yl)methyl]benzamide. Following Lipinski's Rule of Five, N-[(3-amino-1H-1,2,4-triazol-5-yl)methyl]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 N-[(3-amino-1H-1,2,4-triazol-5-yl)methyl]benzamide?
The CAS number of N-[(3-amino-1H-1,2,4-triazol-5-yl)methyl]benzamide is 110181-51-6.
What is the molecular formula of N-[(3-amino-1H-1,2,4-triazol-5-yl)methyl]benzamide?
The molecular formula of N-[(3-amino-1H-1,2,4-triazol-5-yl)methyl]benzamide is C10H11N5O.
What is the molecular weight of N-[(3-amino-1H-1,2,4-triazol-5-yl)methyl]benzamide?
The molecular weight of N-[(3-amino-1H-1,2,4-triazol-5-yl)methyl]benzamide is 217.09636 g/mol.
Where can I buy N-[(3-amino-1H-1,2,4-triazol-5-yl)methyl]benzamide?
You can request a quote for N-[(3-amino-1H-1,2,4-triazol-5-yl)methyl]benzamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-[(3-amino-1H-1,2,4-triazol-5-yl)methyl]benzamide?
Yes, CoreyChem provides custom synthesis services for N-[(3-amino-1H-1,2,4-triazol-5-yl)methyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.