N-(3,5-dichlorophenyl)-1H-1,2,4-triazol-5-amine
TL;DR: N-(3,5-dichlorophenyl)-1H-1,2,4-triazol-5-amine (CAS 400074-75-1) is a chemical compound with molecular formula C8H6Cl2N4 and molecular weight 228.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3,5-dichlorophenyl)-1H-1,2,4-triazol-5-amine
Also Known As: N-(3,5-dichlorophenyl)-1H-1,2,4-triazol-5-amine, (3,5-dichlorophenyl)-(1H-1,2,4-triazol-5-yl)amine, N-(3,5-dichlorophenyl)-1H-1,2,4-triazol-3-amine, 1H-1,2,4-Triazol-5-amine, N-(3,5-dichlorophenyl)-, (3,5-Dichloro-phenyl)-(1H-[1,2,4]triazol-3-yl)-amine
| Molecular Formula | C8H6Cl2N4 |
|---|---|
| Molecular Weight | 228.00 g/mol |
| LogP | 2.8551 |
| Topological Polar Surface Area | 53.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 227.99695 |
| Heavy Atoms | 14 |
| Complexity | 406.66125 |
Chemical Identifiers
| CAS Number | 400074-75-1 |
|---|---|
| SMILES | C1=C(C=C(C=C1Cl)Cl)NC2=NC=NN2 |
Product Overview
N-(3,5-dichlorophenyl)-1H-1,2,4-triazol-5-amine (CAS 400074-75-1), with molecular formula C8H6Cl2N4 and molecular weight 228.00 g/mol. IUPAC: N-(3,5-dichlorophenyl)-1H-1,2,4-triazol-5-amine.
Chemical Property Profile of N-(3,5-dichlorophenyl)-1H-1,2,4-triazol-5-amine
Property Insights of N-(3,5-dichlorophenyl)-1H-1,2,4-triazol-5-amine
The XLogP value of 2.8551 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3,5-dichlorophenyl)-1H-1,2,4-triazol-5-amine. With a topological polar surface area (TPSA) of 53.6 Ų, N-(3,5-dichlorophenyl)-1H-1,2,4-triazol-5-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3,5-dichlorophenyl)-1H-1,2,4-triazol-5-amine has 2 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 N-(3,5-dichlorophenyl)-1H-1,2,4-triazol-5-amine?
The CAS number of N-(3,5-dichlorophenyl)-1H-1,2,4-triazol-5-amine is 400074-75-1.
What is the molecular formula of N-(3,5-dichlorophenyl)-1H-1,2,4-triazol-5-amine?
The molecular formula of N-(3,5-dichlorophenyl)-1H-1,2,4-triazol-5-amine is C8H6Cl2N4.
What is the molecular weight of N-(3,5-dichlorophenyl)-1H-1,2,4-triazol-5-amine?
The molecular weight of N-(3,5-dichlorophenyl)-1H-1,2,4-triazol-5-amine is 228.00 g/mol.
Where can I buy N-(3,5-dichlorophenyl)-1H-1,2,4-triazol-5-amine?
You can request a quote for N-(3,5-dichlorophenyl)-1H-1,2,4-triazol-5-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3,5-dichlorophenyl)-1H-1,2,4-triazol-5-amine?
Yes, KEHONG BIO provides custom synthesis services for N-(3,5-dichlorophenyl)-1H-1,2,4-triazol-5-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.