3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-[[(4-nitrophenyl)m
TL;DR: 3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-[[(4-nitrophenyl)m (CAS 312593-09-2) is a chemical compound with molecular formula C10H6F3N5O2S and molecular weight 317.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(4-nitrophenyl)methylideneamino]-3-(trifluoromethyl)-1H-1,2,4-triazole-5-thione
Also Known As: 3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-[[(4-nitrophenyl)m, 4-[(4-nitrophenyl)methylideneamino]-3-(trifluoromethyl)-1H-1,2,4-triazole-5-thione
| Molecular Formula | C10H6F3N5O2S |
|---|---|
| Molecular Weight | 317.02 g/mol |
| LogP | 2.74989 |
| Topological Polar Surface Area | 89.11 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 317.01944 |
| Heavy Atoms | 21 |
| Complexity | 747.28906 |
Chemical Identifiers
| CAS Number | 312593-09-2 |
|---|---|
| SMILES | C1=CC(=CC=C1C=NN2C(=NNC2=S)C(F)(F)F)[N+](=O)[O-] |
Product Overview
3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-[[(4-nitrophenyl)m (CAS 312593-09-2), with molecular formula C10H6F3N5O2S and molecular weight 317.02 g/mol. IUPAC: 4-[(4-nitrophenyl)methylideneamino]-3-(trifluoromethyl)-1H-1,2,4-triazole-5-thione.
Chemical Property Profile of 3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-[[(4-nitrophenyl)m
Property Insights of 3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-[[(4-nitrophenyl)m
The XLogP value of 2.74989 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-[[(4-nitrophenyl)m. The TPSA of 89.11 Ų falls within the moderate polarity range, balancing permeability and solubility for 3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-[[(4-nitrophenyl)m. Following Lipinski's Rule of Five, 3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-[[(4-nitrophenyl)m 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 3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-[[(4-nitrophenyl)m?
The CAS number of 3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-[[(4-nitrophenyl)m is 312593-09-2.
What is the molecular formula of 3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-[[(4-nitrophenyl)m?
The molecular formula of 3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-[[(4-nitrophenyl)m is C10H6F3N5O2S.
What is the molecular weight of 3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-[[(4-nitrophenyl)m?
The molecular weight of 3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-[[(4-nitrophenyl)m is 317.02 g/mol.
Where can I buy 3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-[[(4-nitrophenyl)m?
You can request a quote for 3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-[[(4-nitrophenyl)m directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-[[(4-nitrophenyl)m?
Yes, KEHONG BIO provides custom synthesis services for 3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-[[(4-nitrophenyl)m and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.