5-amino-1-(4-chlorobenzyl)-1H-1,2,3-triazole-4-carboxamide
TL;DR: 5-amino-1-(4-chlorobenzyl)-1H-1,2,3-triazole-4-carboxamide (CAS 132269-38-6) is a chemical compound with molecular formula C10H10ClN5O and molecular weight 251.05739 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-amino-1-[(4-chlorophenyl)methyl]triazole-4-carboxamide
Also Known As: 5-amino-1-(4-chlorobenzyl)-1H-1,2,3-triazole-4-carboxamide, aminochlorobenzyltriazolecarboxamide, 5-amino-1-[(4-chlorophenyl)methyl]triazole-4-carboxamide, 5-amino-1-[(4-chlorophenyl)methyl]-1H-1,2,3-triazole-4-carboxamide, H-20130
Technical Specifications
| Molecular Formula | C10H10ClN5O |
| Molecular Weight | 251.05739 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 99.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 251.05739 Da |
| Heavy Atoms | 17 |
| Complexity | 282.0 |
| SMILES | C1=CC(=CC=C1CN2C(=C(N=N2)C(=O)N)N)Cl |
| InChIKey | LZYOKUBZSKOHLP-UHFFFAOYSA-N |
Chemical Property Profile of 5-amino-1-(4-chlorobenzyl)-1H-1,2,3-triazole-4-carboxamide
Property Insights of 5-amino-1-(4-chlorobenzyl)-1H-1,2,3-triazole-4-carboxamide
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-amino-1-(4-chlorobenzyl)-1H-1,2,3-triazole-4-carboxamide. The TPSA of 99.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-amino-1-(4-chlorobenzyl)-1H-1,2,3-triazole-4-carboxamide. Following Lipinski's Rule of Five, 5-amino-1-(4-chlorobenzyl)-1H-1,2,3-triazole-4-carboxamide has 2 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 5-amino-1-(4-chlorobenzyl)-1H-1,2,3-triazole-4-carboxamide?
The CAS number of 5-amino-1-(4-chlorobenzyl)-1H-1,2,3-triazole-4-carboxamide is 132269-38-6.
What is the molecular formula of 5-amino-1-(4-chlorobenzyl)-1H-1,2,3-triazole-4-carboxamide?
The molecular formula of 5-amino-1-(4-chlorobenzyl)-1H-1,2,3-triazole-4-carboxamide is C10H10ClN5O.
What is the molecular weight of 5-amino-1-(4-chlorobenzyl)-1H-1,2,3-triazole-4-carboxamide?
The molecular weight of 5-amino-1-(4-chlorobenzyl)-1H-1,2,3-triazole-4-carboxamide is 251.05739 g/mol.
Where can I buy 5-amino-1-(4-chlorobenzyl)-1H-1,2,3-triazole-4-carboxamide?
You can request a quote for 5-amino-1-(4-chlorobenzyl)-1H-1,2,3-triazole-4-carboxamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-amino-1-(4-chlorobenzyl)-1H-1,2,3-triazole-4-carboxamide?
Yes, CoreyChem provides custom synthesis services for 5-amino-1-(4-chlorobenzyl)-1H-1,2,3-triazole-4-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.