![4-({[4-(Diethylamino)phenyl]methylidene}amino)-5-(5-methyl-1H-pyrazol-3-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione structure](/static/products/4809/4809-04-5.webp)
4-({[4-(Diethylamino)phenyl]methylidene}amino)-5-(5-methyl-1H-pyrazol-3-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
TL;DR: 4-({[4-(Diethylamino)phenyl]methylidene}amino)-5-(5-methyl-1H-pyrazol-3-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione (CAS 4809-04-5) is a chemical compound with molecular formula C17H21N7S and molecular weight 355.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[4-(diethylamino)phenyl]methylideneamino]-3-(5-methyl-1H-pyrazol-3-yl)-1H-1,2,4-triazole-5-thione
Also Known As: 4-({[4-(Diethylamino)phenyl]methylidene}amino)-5-(5-methyl-1H-pyrazol-3-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione, 4-[(4-diethylaminophenyl)methylideneamino]-5-(5-methyl-1H-pyrazol-3-yl)-2H-1,2,4-triazole-3-thione, 4-[[4-(diethylamino)phenyl]methylideneamino]-3-(5-methyl-1H-pyrazol-3-yl)-1H-1,2,4-triazole-5-thione
| Molecular Formula | C17H21N7S |
|---|---|
| Molecular Weight | 355.16 g/mol |
| LogP | 3.36761 |
| Topological Polar Surface Area | 77.89 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 355.15793 |
| Heavy Atoms | 25 |
| Complexity | 913.127 |
Chemical Identifiers
| CAS Number | 4809-04-5 |
|---|---|
| SMILES | CCN(CC)C1=CC=C(C=C1)C=NN2C(=NNC2=S)C3=NNC(=C3)C |
Product Overview
4-({[4-(Diethylamino)phenyl]methylidene}amino)-5-(5-methyl-1H-pyrazol-3-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione (CAS 4809-04-5), with molecular formula C17H21N7S and molecular weight 355.16 g/mol. IUPAC: 4-[[4-(diethylamino)phenyl]methylideneamino]-3-(5-methyl-1H-pyrazol-3-yl)-1H-1,2,4-triazole-5-thione.
Chemical Property Profile of 4-({[4-(Diethylamino)phenyl]methylidene}amino)-5-(5-methyl-1H-pyrazol-3-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Property Insights of 4-({[4-(Diethylamino)phenyl]methylidene}amino)-5-(5-methyl-1H-pyrazol-3-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
The XLogP value of 3.36761 indicates that 4-({[4-(Diethylamino)phenyl]methylidene}amino)-5-(5-methyl-1H-pyrazol-3-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.89 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-({[4-(Diethylamino)phenyl]methylidene}amino)-5-(5-methyl-1H-pyrazol-3-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione. Following Lipinski's Rule of Five, 4-({[4-(Diethylamino)phenyl]methylidene}amino)-5-(5-methyl-1H-pyrazol-3-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione has 2 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 4-({[4-(Diethylamino)phenyl]methylidene}amino)-5-(5-methyl-1H-pyrazol-3-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione?
The CAS number of 4-({[4-(Diethylamino)phenyl]methylidene}amino)-5-(5-methyl-1H-pyrazol-3-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione is 4809-04-5.
What is the molecular formula of 4-({[4-(Diethylamino)phenyl]methylidene}amino)-5-(5-methyl-1H-pyrazol-3-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione?
The molecular formula of 4-({[4-(Diethylamino)phenyl]methylidene}amino)-5-(5-methyl-1H-pyrazol-3-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione is C17H21N7S.
What is the molecular weight of 4-({[4-(Diethylamino)phenyl]methylidene}amino)-5-(5-methyl-1H-pyrazol-3-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione?
The molecular weight of 4-({[4-(Diethylamino)phenyl]methylidene}amino)-5-(5-methyl-1H-pyrazol-3-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione is 355.16 g/mol.
Where can I buy 4-({[4-(Diethylamino)phenyl]methylidene}amino)-5-(5-methyl-1H-pyrazol-3-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione?
You can request a quote for 4-({[4-(Diethylamino)phenyl]methylidene}amino)-5-(5-methyl-1H-pyrazol-3-yl)-2,4-dihydro-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 4-({[4-(Diethylamino)phenyl]methylidene}amino)-5-(5-methyl-1H-pyrazol-3-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione?
Yes, KEHONG BIO provides custom synthesis services for 4-({[4-(Diethylamino)phenyl]methylidene}amino)-5-(5-methyl-1H-pyrazol-3-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.