3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-amino-5-(1-(4-chlorophenoxy)ethyl)-
TL;DR: 3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-amino-5-(1-(4-chlorophenoxy)ethyl)- (CAS 115398-69-1) is a chemical compound with molecular formula C10H11ClN4OS and molecular weight 270.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-amino-3-[1-(4-chlorophenoxy)ethyl]-1H-1,2,4-triazole-5-thione
Also Known As: 2,4-Dihydro-4-amino-5-(1-(4-chlorophenoxy)ethyl)-3H-1,2,4-triazole-3-thione, 3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-amino-5-(1-(4-chlorophenoxy)ethyl)-, 4-amino-3-[1-(4-chlorophenoxy)ethyl]-1H-1,2,4-triazole-5-thione, 4-Amino-5-[1-(4-chlorophenoxy)ethyl]-4H-1,2,4-triazole-3-thiol, 4,4-Diethoxy-9-oxo-3,10-dioxa-8-aza-4-siladodecan-12-yl methacrylate
| Molecular Formula | C10H11ClN4OS |
|---|---|
| Molecular Weight | 270.03 g/mol |
| LogP | 2.44789 |
| Topological Polar Surface Area | 68.86 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 270.0342 |
| Heavy Atoms | 17 |
| Complexity | 562.43005 |
Chemical Identifiers
| CAS Number | 115398-69-1 |
|---|---|
| SMILES | CC(C1=NNC(=S)N1N)OC2=CC=C(C=C2)Cl |
Product Overview
3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-amino-5-(1-(4-chlorophenoxy)ethyl)- (CAS 115398-69-1), with molecular formula C10H11ClN4OS and molecular weight 270.03 g/mol. IUPAC: 4-amino-3-[1-(4-chlorophenoxy)ethyl]-1H-1,2,4-triazole-5-thione.
Chemical Property Profile of 3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-amino-5-(1-(4-chlorophenoxy)ethyl)-
Property Insights of 3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-amino-5-(1-(4-chlorophenoxy)ethyl)-
The XLogP value of 2.44789 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-amino-5-(1-(4-chlorophenoxy)ethyl)-. The TPSA of 68.86 Ų falls within the moderate polarity range, balancing permeability and solubility for 3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-amino-5-(1-(4-chlorophenoxy)ethyl)-. Following Lipinski's Rule of Five, 3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-amino-5-(1-(4-chlorophenoxy)ethyl)- has 2 hydrogen bond donor(s) and 4 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-amino-5-(1-(4-chlorophenoxy)ethyl)-?
The CAS number of 3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-amino-5-(1-(4-chlorophenoxy)ethyl)- is 115398-69-1.
What is the molecular formula of 3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-amino-5-(1-(4-chlorophenoxy)ethyl)-?
The molecular formula of 3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-amino-5-(1-(4-chlorophenoxy)ethyl)- is C10H11ClN4OS.
What is the molecular weight of 3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-amino-5-(1-(4-chlorophenoxy)ethyl)-?
The molecular weight of 3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-amino-5-(1-(4-chlorophenoxy)ethyl)- is 270.03 g/mol.
Where can I buy 3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-amino-5-(1-(4-chlorophenoxy)ethyl)-?
You can request a quote for 3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-amino-5-(1-(4-chlorophenoxy)ethyl)- 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-amino-5-(1-(4-chlorophenoxy)ethyl)-?
Yes, KEHONG BIO provides custom synthesis services for 3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-amino-5-(1-(4-chlorophenoxy)ethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.