F1252-0239
TL;DR: F1252-0239 (CAS 539804-51-8) is a chemical compound with molecular formula C18H18BrN5OS and molecular weight 431.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-amino-5-(3-bromophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2,5-dimethylphenyl)acetamide
Also Known As: F1252-0239, 2-((4-amino-5-(3-bromophenyl)-4H-1,2,4-triazol-3-yl)thio)-N-(2,5-dimethylphenyl)acetamide, 2-[[4-amino-5-(3-bromophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2,5-dimethylphenyl)acetamide, 2-{[4-amino-5-(3-bromophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,5-dimethylphenyl)acetamide
| Molecular Formula | C18H18BrN5OS |
|---|---|
| Molecular Weight | 431.04 g/mol |
| LogP | 3.76904 |
| Topological Polar Surface Area | 85.83 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 431.04153 |
| Heavy Atoms | 26 |
| Complexity | 956.5046 |
Chemical Identifiers
| CAS Number | 539804-51-8 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C)NC(=O)CSC2=NN=C(N2N)C3=CC(=CC=C3)Br |
Product Overview
F1252-0239 (CAS 539804-51-8), with molecular formula C18H18BrN5OS and molecular weight 431.04 g/mol. IUPAC: 2-[[4-amino-5-(3-bromophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2,5-dimethylphenyl)acetamide.
Chemical Property Profile of F1252-0239
Property Insights of F1252-0239
The XLogP value of 3.76904 indicates that F1252-0239 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.83 Ų falls within the moderate polarity range, balancing permeability and solubility for F1252-0239. Following Lipinski's Rule of Five, F1252-0239 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 F1252-0239?
The CAS number of F1252-0239 is 539804-51-8.
What is the molecular formula of F1252-0239?
The molecular formula of F1252-0239 is C18H18BrN5OS.
What is the molecular weight of F1252-0239?
The molecular weight of F1252-0239 is 431.04 g/mol.
Where can I buy F1252-0239?
You can request a quote for F1252-0239 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1252-0239?
Yes, KEHONG BIO provides custom synthesis services for F1252-0239 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.