N-(3,4-dimethoxyphenyl)-1H-1,2,4-triazole-3-carboxamide
TL;DR: N-(3,4-dimethoxyphenyl)-1H-1,2,4-triazole-3-carboxamide (CAS 634169-82-7) is a chemical compound with molecular formula C11H12N4O3 and molecular weight 248.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3,4-dimethoxyphenyl)-1H-1,2,4-triazole-5-carboxamide
Also Known As: N-(3,4-dimethoxyphenyl)-1H-1,2,4-triazole-3-carboxamide, 1H-1,2,4-triazol-3-yl-N-(3,4-dimethoxyphenyl)carboxamide, A3249/0138037, N-(3,4-dimethoxyphenyl)-1H-1,2,4-triazole-5-carboxamide, 1H-1,2,4-Triazole-3-carboxamide, N-(3,4-dimethoxyphenyl)- (9CI)
| Molecular Formula | C11H12N4O3 |
|---|---|
| Molecular Weight | 248.09 g/mol |
| LogP | 1.0742 |
| Topological Polar Surface Area | 89.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 248.09094 |
| Heavy Atoms | 18 |
| Complexity | 539.22626 |
Chemical Identifiers
| CAS Number | 634169-82-7 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)NC(=O)C2=NC=NN2)OC |
Product Overview
N-(3,4-dimethoxyphenyl)-1H-1,2,4-triazole-3-carboxamide (CAS 634169-82-7), with molecular formula C11H12N4O3 and molecular weight 248.09 g/mol. IUPAC: N-(3,4-dimethoxyphenyl)-1H-1,2,4-triazole-5-carboxamide.
Chemical Property Profile of N-(3,4-dimethoxyphenyl)-1H-1,2,4-triazole-3-carboxamide
Property Insights of N-(3,4-dimethoxyphenyl)-1H-1,2,4-triazole-3-carboxamide
The XLogP value of 1.0742 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3,4-dimethoxyphenyl)-1H-1,2,4-triazole-3-carboxamide. The TPSA of 89.13 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3,4-dimethoxyphenyl)-1H-1,2,4-triazole-3-carboxamide. Following Lipinski's Rule of Five, N-(3,4-dimethoxyphenyl)-1H-1,2,4-triazole-3-carboxamide has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-(3,4-dimethoxyphenyl)-1H-1,2,4-triazole-3-carboxamide?
The CAS number of N-(3,4-dimethoxyphenyl)-1H-1,2,4-triazole-3-carboxamide is 634169-82-7.
What is the molecular formula of N-(3,4-dimethoxyphenyl)-1H-1,2,4-triazole-3-carboxamide?
The molecular formula of N-(3,4-dimethoxyphenyl)-1H-1,2,4-triazole-3-carboxamide is C11H12N4O3.
What is the molecular weight of N-(3,4-dimethoxyphenyl)-1H-1,2,4-triazole-3-carboxamide?
The molecular weight of N-(3,4-dimethoxyphenyl)-1H-1,2,4-triazole-3-carboxamide is 248.09 g/mol.
Where can I buy N-(3,4-dimethoxyphenyl)-1H-1,2,4-triazole-3-carboxamide?
You can request a quote for N-(3,4-dimethoxyphenyl)-1H-1,2,4-triazole-3-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3,4-dimethoxyphenyl)-1H-1,2,4-triazole-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3,4-dimethoxyphenyl)-1H-1,2,4-triazole-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.