![5-[4-(dimethylamino)phenyl]-4-methyl-4H-1,2,4-triazole-3-thiol structure](/static/products/2483/24838-13-9.webp)
5-[4-(dimethylamino)phenyl]-4-methyl-4H-1,2,4-triazole-3-thiol
TL;DR: 5-[4-(dimethylamino)phenyl]-4-methyl-4H-1,2,4-triazole-3-thiol (CAS 24838-13-9) is a chemical compound with molecular formula C11H14N4S and molecular weight 234.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4-(dimethylamino)phenyl]-4-methyl-1H-1,2,4-triazole-5-thione
Also Known As: 5-[4-(dimethylamino)phenyl]-4-methyl-4H-1,2,4-triazole-3-thiol, 8725AE, BAS 15432955, 3-[4-(dimethylamino)phenyl]-4-methyl-1H-1,2,4-triazole-5-thione, Y-1163
| Molecular Formula | C11H14N4S |
|---|---|
| Molecular Weight | 234.09 g/mol |
| LogP | 2.21069 |
| Topological Polar Surface Area | 36.85 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 234.09392 |
| Heavy Atoms | 16 |
| Complexity | 535.85736 |
Chemical Identifiers
| CAS Number | 24838-13-9 |
|---|---|
| SMILES | CN1C(=NNC1=S)C2=CC=C(C=C2)N(C)C |
Product Overview
5-[4-(dimethylamino)phenyl]-4-methyl-4H-1,2,4-triazole-3-thiol (CAS 24838-13-9), with molecular formula C11H14N4S and molecular weight 234.09 g/mol. IUPAC: 3-[4-(dimethylamino)phenyl]-4-methyl-1H-1,2,4-triazole-5-thione.
Chemical Property Profile of 5-[4-(dimethylamino)phenyl]-4-methyl-4H-1,2,4-triazole-3-thiol
Property Insights of 5-[4-(dimethylamino)phenyl]-4-methyl-4H-1,2,4-triazole-3-thiol
The XLogP value of 2.21069 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-[4-(dimethylamino)phenyl]-4-methyl-4H-1,2,4-triazole-3-thiol. With a topological polar surface area (TPSA) of 36.85 Ų, 5-[4-(dimethylamino)phenyl]-4-methyl-4H-1,2,4-triazole-3-thiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-[4-(dimethylamino)phenyl]-4-methyl-4H-1,2,4-triazole-3-thiol has 1 hydrogen bond donor(s) and 3 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-[4-(dimethylamino)phenyl]-4-methyl-4H-1,2,4-triazole-3-thiol?
The CAS number of 5-[4-(dimethylamino)phenyl]-4-methyl-4H-1,2,4-triazole-3-thiol is 24838-13-9.
What is the molecular formula of 5-[4-(dimethylamino)phenyl]-4-methyl-4H-1,2,4-triazole-3-thiol?
The molecular formula of 5-[4-(dimethylamino)phenyl]-4-methyl-4H-1,2,4-triazole-3-thiol is C11H14N4S.
What is the molecular weight of 5-[4-(dimethylamino)phenyl]-4-methyl-4H-1,2,4-triazole-3-thiol?
The molecular weight of 5-[4-(dimethylamino)phenyl]-4-methyl-4H-1,2,4-triazole-3-thiol is 234.09 g/mol.
Where can I buy 5-[4-(dimethylamino)phenyl]-4-methyl-4H-1,2,4-triazole-3-thiol?
You can request a quote for 5-[4-(dimethylamino)phenyl]-4-methyl-4H-1,2,4-triazole-3-thiol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-[4-(dimethylamino)phenyl]-4-methyl-4H-1,2,4-triazole-3-thiol?
Yes, KEHONG BIO provides custom synthesis services for 5-[4-(dimethylamino)phenyl]-4-methyl-4H-1,2,4-triazole-3-thiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.