![1H-1,2,4-Triazole-3,5-diamine, N-[(4-fluorophenyl)methyl]- structure](/static/products/872/87253-79-0.png)
1H-1,2,4-Triazole-3,5-diamine, N-[(4-fluorophenyl)methyl]-
TL;DR: 1H-1,2,4-Triazole-3,5-diamine, N-[(4-fluorophenyl)methyl]- (CAS 87253-79-0) is a chemical compound with molecular formula C9H10FN5 and molecular weight 207.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-N-[(4-fluorophenyl)methyl]-1H-1,2,4-triazole-3,5-diamine
Also Known As: ASN 12403186, 1H-1,2,4-Triazole-3,5-diamine, N-[(4-fluorophenyl)methyl]-, 3-N-[(4-fluorophenyl)methyl]-1H-1,2,4-triazole-3,5-diamine, 1H-1,2,4-Triazole-3,5-diamine,N-[(4-fluorophenyl)methyl], N*3*-(4-Fluoro-benzyl)-1H-[1,2,4]triazole-3,5-diamine
| Molecular Formula | C9H10FN5 |
|---|---|
| Molecular Weight | 207.09 g/mol |
| LogP | 1.1381 |
| Topological Polar Surface Area | 79.62 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 207.09203 |
| Heavy Atoms | 15 |
| Complexity | 436.01828 |
Chemical Identifiers
| CAS Number | 87253-79-0 |
|---|---|
| SMILES | C1=CC(=CC=C1CNC2=NNC(=N2)N)F |
Product Overview
1H-1,2,4-Triazole-3,5-diamine, N-[(4-fluorophenyl)methyl]- (CAS 87253-79-0), with molecular formula C9H10FN5 and molecular weight 207.09 g/mol. IUPAC: 3-N-[(4-fluorophenyl)methyl]-1H-1,2,4-triazole-3,5-diamine.
Chemical Property Profile of 1H-1,2,4-Triazole-3,5-diamine, N-[(4-fluorophenyl)methyl]-
Property Insights of 1H-1,2,4-Triazole-3,5-diamine, N-[(4-fluorophenyl)methyl]-
The XLogP value of 1.1381 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-1,2,4-Triazole-3,5-diamine, N-[(4-fluorophenyl)methyl]-. The TPSA of 79.62 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-1,2,4-Triazole-3,5-diamine, N-[(4-fluorophenyl)methyl]-. Following Lipinski's Rule of Five, 1H-1,2,4-Triazole-3,5-diamine, N-[(4-fluorophenyl)methyl]- 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
Frequently Asked Questions
What is the CAS number of 1H-1,2,4-Triazole-3,5-diamine, N-[(4-fluorophenyl)methyl]-?
The CAS number of 1H-1,2,4-Triazole-3,5-diamine, N-[(4-fluorophenyl)methyl]- is 87253-79-0.
What is the molecular formula of 1H-1,2,4-Triazole-3,5-diamine, N-[(4-fluorophenyl)methyl]-?
The molecular formula of 1H-1,2,4-Triazole-3,5-diamine, N-[(4-fluorophenyl)methyl]- is C9H10FN5.
What is the molecular weight of 1H-1,2,4-Triazole-3,5-diamine, N-[(4-fluorophenyl)methyl]-?
The molecular weight of 1H-1,2,4-Triazole-3,5-diamine, N-[(4-fluorophenyl)methyl]- is 207.09 g/mol.
Where can I buy 1H-1,2,4-Triazole-3,5-diamine, N-[(4-fluorophenyl)methyl]-?
You can request a quote for 1H-1,2,4-Triazole-3,5-diamine, N-[(4-fluorophenyl)methyl]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-1,2,4-Triazole-3,5-diamine, N-[(4-fluorophenyl)methyl]-?
Yes, KEHONG BIO provides custom synthesis services for 1H-1,2,4-Triazole-3,5-diamine, N-[(4-fluorophenyl)methyl]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.