3,5-dimethyl-N,N-diphenyl-1H-1,2,4-triazole-1-carboxamide
TL;DR: 3,5-dimethyl-N,N-diphenyl-1H-1,2,4-triazole-1-carboxamide (CAS 691398-69-3) is a chemical compound with molecular formula C17H16N4O and molecular weight 292.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-dimethyl-N,N-diphenyl-1,2,4-triazole-1-carboxamide
Also Known As: 3,5-dimethyl-N,N-diphenyl-1H-1,2,4-triazole-1-carboxamide, (3,5-dimethyl(1,2,4-triazolyl))-N,N-dibenzamide, 3,5-dimethyl-N,N-diphenyl-1,2,4-triazole-1-carboxamide, N,N-diphenyl-3,5-dimethyl-1H-1,2,4-triazole-1-carboxamide
| Molecular Formula | C17H16N4O |
|---|---|
| Molecular Weight | 292.13 g/mol |
| LogP | 3.70134 |
| Topological Polar Surface Area | 51.02 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 292.13242 |
| Heavy Atoms | 22 |
| Complexity | 741.43335 |
Chemical Identifiers
| CAS Number | 691398-69-3 |
|---|---|
| SMILES | CC1=NN(C(=N1)C)C(=O)N(C2=CC=CC=C2)C3=CC=CC=C3 |
Product Overview
3,5-dimethyl-N,N-diphenyl-1H-1,2,4-triazole-1-carboxamide (CAS 691398-69-3), with molecular formula C17H16N4O and molecular weight 292.13 g/mol. IUPAC: 3,5-dimethyl-N,N-diphenyl-1,2,4-triazole-1-carboxamide.
Chemical Property Profile of 3,5-dimethyl-N,N-diphenyl-1H-1,2,4-triazole-1-carboxamide
Property Insights of 3,5-dimethyl-N,N-diphenyl-1H-1,2,4-triazole-1-carboxamide
The XLogP value of 3.70134 indicates that 3,5-dimethyl-N,N-diphenyl-1H-1,2,4-triazole-1-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.02 Ų, 3,5-dimethyl-N,N-diphenyl-1H-1,2,4-triazole-1-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,5-dimethyl-N,N-diphenyl-1H-1,2,4-triazole-1-carboxamide has 0 hydrogen bond donor(s) and 3 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 3,5-dimethyl-N,N-diphenyl-1H-1,2,4-triazole-1-carboxamide?
The CAS number of 3,5-dimethyl-N,N-diphenyl-1H-1,2,4-triazole-1-carboxamide is 691398-69-3.
What is the molecular formula of 3,5-dimethyl-N,N-diphenyl-1H-1,2,4-triazole-1-carboxamide?
The molecular formula of 3,5-dimethyl-N,N-diphenyl-1H-1,2,4-triazole-1-carboxamide is C17H16N4O.
What is the molecular weight of 3,5-dimethyl-N,N-diphenyl-1H-1,2,4-triazole-1-carboxamide?
The molecular weight of 3,5-dimethyl-N,N-diphenyl-1H-1,2,4-triazole-1-carboxamide is 292.13 g/mol.
Where can I buy 3,5-dimethyl-N,N-diphenyl-1H-1,2,4-triazole-1-carboxamide?
You can request a quote for 3,5-dimethyl-N,N-diphenyl-1H-1,2,4-triazole-1-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-dimethyl-N,N-diphenyl-1H-1,2,4-triazole-1-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 3,5-dimethyl-N,N-diphenyl-1H-1,2,4-triazole-1-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.