F2563-0842
TL;DR: F2563-0842 (CAS 896311-57-2) is a chemical compound with molecular formula C22H27N5OS and molecular weight 409.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(5-cyclohexyl-4-pyrrol-1-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(2,4-dimethylphenyl)acetamide
Also Known As: F2563-0842, 2-[(5-cyclohexyl-4-pyrrol-1-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(2,4-dimethylphenyl)acetamide, 2-{[5-cyclohexyl-4-(1H-pyrrol-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,4-dimethylphenyl)acetamide, 2-((5-cyclohexyl-4-(1H-pyrrol-1-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(2,4-dimethylphenyl)acetamide
| Molecular Formula | C22H27N5OS |
|---|---|
| Molecular Weight | 409.19 g/mol |
| LogP | 4.78634 |
| Topological Polar Surface Area | 64.74 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 409.19363 |
| Heavy Atoms | 29 |
| Complexity | 973.26154 |
Chemical Identifiers
| CAS Number | 896311-57-2 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)NC(=O)CSC2=NN=C(N2N3C=CC=C3)C4CCCCC4)C |
Product Overview
F2563-0842 (CAS 896311-57-2), with molecular formula C22H27N5OS and molecular weight 409.19 g/mol. IUPAC: 2-[(5-cyclohexyl-4-pyrrol-1-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(2,4-dimethylphenyl)acetamide.
Chemical Property Profile of F2563-0842
Property Insights of F2563-0842
The XLogP value of 4.78634 indicates that F2563-0842 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.74 Ų falls within the moderate polarity range, balancing permeability and solubility for F2563-0842. Following Lipinski's Rule of Five, F2563-0842 has 1 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 F2563-0842?
The CAS number of F2563-0842 is 896311-57-2.
What is the molecular formula of F2563-0842?
The molecular formula of F2563-0842 is C22H27N5OS.
What is the molecular weight of F2563-0842?
The molecular weight of F2563-0842 is 409.19 g/mol.
Where can I buy F2563-0842?
You can request a quote for F2563-0842 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F2563-0842?
Yes, KEHONG BIO provides custom synthesis services for F2563-0842 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.