![5-(2-Fluorophenyl)-2,4-dihydro-4-[[(2-nitrophenyl)methylene]amino]-3H-1,2,4-triazole-3-thione structure](/static/products/6773/677304-08-4.webp)
5-(2-Fluorophenyl)-2,4-dihydro-4-[[(2-nitrophenyl)methylene]amino]-3H-1,2,4-triazole-3-thione
TL;DR: 5-(2-Fluorophenyl)-2,4-dihydro-4-[[(2-nitrophenyl)methylene]amino]-3H-1,2,4-triazole-3-thione (CAS 677304-08-4) is a chemical compound with molecular formula C15H10FN5O2S and molecular weight 343.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-fluorophenyl)-4-[(2-nitrophenyl)methylideneamino]-1H-1,2,4-triazole-5-thione
Also Known As: 5-(2-Fluorophenyl)-2,4-dihydro-4-[[(2-nitrophenyl)methylene]amino]-3H-1,2,4-triazole-3-thione, 3-(2-fluorophenyl)-4-[(2-nitrophenyl)methylideneamino]-1H-1,2,4-triazole-5-thione, 5-(2-Fluorophenyl)-2,4-dihydro-4-(((2-nitrophenyl)methylene)amino)-3H-1,2,4-triazole-3-thione, 5-(2-Fluorophenyl)-4-{[(2-nitrophenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione, RefChem:529491
| Molecular Formula | C15H10FN5O2S |
|---|---|
| Molecular Weight | 343.05 g/mol |
| LogP | 3.53719 |
| Topological Polar Surface Area | 89.11 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 343.05392 |
| Heavy Atoms | 24 |
| Complexity | 995.27954 |
Chemical Identifiers
| CAS Number | 677304-08-4 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C=NN2C(=NNC2=S)C3=CC=CC=C3F)[N+](=O)[O-] |
Product Overview
5-(2-Fluorophenyl)-2,4-dihydro-4-[[(2-nitrophenyl)methylene]amino]-3H-1,2,4-triazole-3-thione (CAS 677304-08-4), with molecular formula C15H10FN5O2S and molecular weight 343.05 g/mol. IUPAC: 3-(2-fluorophenyl)-4-[(2-nitrophenyl)methylideneamino]-1H-1,2,4-triazole-5-thione.
Chemical Property Profile of 5-(2-Fluorophenyl)-2,4-dihydro-4-[[(2-nitrophenyl)methylene]amino]-3H-1,2,4-triazole-3-thione
Property Insights of 5-(2-Fluorophenyl)-2,4-dihydro-4-[[(2-nitrophenyl)methylene]amino]-3H-1,2,4-triazole-3-thione
The XLogP value of 3.53719 indicates that 5-(2-Fluorophenyl)-2,4-dihydro-4-[[(2-nitrophenyl)methylene]amino]-3H-1,2,4-triazole-3-thione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.11 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(2-Fluorophenyl)-2,4-dihydro-4-[[(2-nitrophenyl)methylene]amino]-3H-1,2,4-triazole-3-thione. Following Lipinski's Rule of Five, 5-(2-Fluorophenyl)-2,4-dihydro-4-[[(2-nitrophenyl)methylene]amino]-3H-1,2,4-triazole-3-thione has 1 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 5-(2-Fluorophenyl)-2,4-dihydro-4-[[(2-nitrophenyl)methylene]amino]-3H-1,2,4-triazole-3-thione?
The CAS number of 5-(2-Fluorophenyl)-2,4-dihydro-4-[[(2-nitrophenyl)methylene]amino]-3H-1,2,4-triazole-3-thione is 677304-08-4.
What is the molecular formula of 5-(2-Fluorophenyl)-2,4-dihydro-4-[[(2-nitrophenyl)methylene]amino]-3H-1,2,4-triazole-3-thione?
The molecular formula of 5-(2-Fluorophenyl)-2,4-dihydro-4-[[(2-nitrophenyl)methylene]amino]-3H-1,2,4-triazole-3-thione is C15H10FN5O2S.
What is the molecular weight of 5-(2-Fluorophenyl)-2,4-dihydro-4-[[(2-nitrophenyl)methylene]amino]-3H-1,2,4-triazole-3-thione?
The molecular weight of 5-(2-Fluorophenyl)-2,4-dihydro-4-[[(2-nitrophenyl)methylene]amino]-3H-1,2,4-triazole-3-thione is 343.05 g/mol.
Where can I buy 5-(2-Fluorophenyl)-2,4-dihydro-4-[[(2-nitrophenyl)methylene]amino]-3H-1,2,4-triazole-3-thione?
You can request a quote for 5-(2-Fluorophenyl)-2,4-dihydro-4-[[(2-nitrophenyl)methylene]amino]-3H-1,2,4-triazole-3-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(2-Fluorophenyl)-2,4-dihydro-4-[[(2-nitrophenyl)methylene]amino]-3H-1,2,4-triazole-3-thione?
Yes, KEHONG BIO provides custom synthesis services for 5-(2-Fluorophenyl)-2,4-dihydro-4-[[(2-nitrophenyl)methylene]amino]-3H-1,2,4-triazole-3-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.