4-((9-Anthrylmethylene)amino)-5-(4-F-PH)-4H-1,2,4-triazol-3-YL hydrosulfide
TL;DR: 4-((9-Anthrylmethylene)amino)-5-(4-F-PH)-4H-1,2,4-triazol-3-YL hydrosulfide (CAS 577998-87-9) is a chemical compound with molecular formula C23H15FN4S and molecular weight 398.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(E)-anthracen-9-ylmethylideneamino]-3-(4-fluorophenyl)-1H-1,2,4-triazole-5-thione
Also Known As: Salor-int l406767-1ea, 4-((Anthracen-9-ylmethylene)amino)-3-(4-fluorophenyl)-1H-1,2,4-triazole-5(4H)-thione, 4-((9-ANTHRYLMETHYLENE)AMINO)-5-(4-F-PH)-4H-1,2,4-TRIAZOL-3-YL HYDROSULFIDE, (E)-4-((anthracen-9-ylmethylene)amino)-5-(4-fluorophenyl)-4H-1,2,4-triazole-3-thiol, 4-((1E)-2-(9-anthryl)-1-azavinyl)-5-(4-fluorophenyl)-1,2,4-triazole-3-thiol
| Molecular Formula | C23H15FN4S |
|---|---|
| Molecular Weight | 398.10 g/mol |
| LogP | 5.93539 |
| Topological Polar Surface Area | 45.97 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 398.10016 |
| Heavy Atoms | 29 |
| Complexity | 1377.3057 |
Chemical Identifiers
| CAS Number | 577998-87-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=C3C=CC=CC3=C2/C=N/N4C(=NNC4=S)C5=CC=C(C=C5)F |
Product Overview
4-((9-Anthrylmethylene)amino)-5-(4-F-PH)-4H-1,2,4-triazol-3-YL hydrosulfide (CAS 577998-87-9), with molecular formula C23H15FN4S and molecular weight 398.10 g/mol. IUPAC: 4-[(E)-anthracen-9-ylmethylideneamino]-3-(4-fluorophenyl)-1H-1,2,4-triazole-5-thione.
Chemical Property Profile of 4-((9-Anthrylmethylene)amino)-5-(4-F-PH)-4H-1,2,4-triazol-3-YL hydrosulfide
Property Insights of 4-((9-Anthrylmethylene)amino)-5-(4-F-PH)-4H-1,2,4-triazol-3-YL hydrosulfide
The XLogP value of 5.93539 indicates that 4-((9-Anthrylmethylene)amino)-5-(4-F-PH)-4H-1,2,4-triazol-3-YL hydrosulfide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.97 Ų, 4-((9-Anthrylmethylene)amino)-5-(4-F-PH)-4H-1,2,4-triazol-3-YL hydrosulfide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-((9-Anthrylmethylene)amino)-5-(4-F-PH)-4H-1,2,4-triazol-3-YL hydrosulfide has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-((9-Anthrylmethylene)amino)-5-(4-F-PH)-4H-1,2,4-triazol-3-YL hydrosulfide?
The CAS number of 4-((9-Anthrylmethylene)amino)-5-(4-F-PH)-4H-1,2,4-triazol-3-YL hydrosulfide is 577998-87-9.
What is the molecular formula of 4-((9-Anthrylmethylene)amino)-5-(4-F-PH)-4H-1,2,4-triazol-3-YL hydrosulfide?
The molecular formula of 4-((9-Anthrylmethylene)amino)-5-(4-F-PH)-4H-1,2,4-triazol-3-YL hydrosulfide is C23H15FN4S.
What is the molecular weight of 4-((9-Anthrylmethylene)amino)-5-(4-F-PH)-4H-1,2,4-triazol-3-YL hydrosulfide?
The molecular weight of 4-((9-Anthrylmethylene)amino)-5-(4-F-PH)-4H-1,2,4-triazol-3-YL hydrosulfide is 398.10 g/mol.
Where can I buy 4-((9-Anthrylmethylene)amino)-5-(4-F-PH)-4H-1,2,4-triazol-3-YL hydrosulfide?
You can request a quote for 4-((9-Anthrylmethylene)amino)-5-(4-F-PH)-4H-1,2,4-triazol-3-YL hydrosulfide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-((9-Anthrylmethylene)amino)-5-(4-F-PH)-4H-1,2,4-triazol-3-YL hydrosulfide?
Yes, KEHONG BIO provides custom synthesis services for 4-((9-Anthrylmethylene)amino)-5-(4-F-PH)-4H-1,2,4-triazol-3-YL hydrosulfide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.