F2563-0495
TL;DR: F2563-0495 (CAS 896299-56-2) is a chemical compound with molecular formula C18H18F3N5OS and molecular weight 409.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(5-propyl-4-pyrrol-1-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[2-(trifluoromethyl)phenyl]acetamide
Also Known As: F2563-0495, 2-((5-propyl-4-(1H-pyrrol-1-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(2-(trifluoromethyl)phenyl)acetamide, 2-[(5-propyl-4-pyrrol-1-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[2-(trifluoromethyl)phenyl]acetamide, 2-{[5-propyl-4-(1H-pyrrol-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[2-(trifluoromethyl)phenyl]acetamide, N-o-(trifluoromethyl)phenyl[5-propyl-4-(1-pyrrolyl)-4H-1,2,4-triazol-3-ylthio]acetamide
| Molecular Formula | C18H18F3N5OS |
|---|---|
| Molecular Weight | 409.12 g/mol |
| LogP | 4.0931 |
| Topological Polar Surface Area | 64.74 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 409.1184 |
| Heavy Atoms | 28 |
| Complexity | 937.1017 |
Chemical Identifiers
| CAS Number | 896299-56-2 |
|---|---|
| SMILES | CCCC1=NN=C(N1N2C=CC=C2)SCC(=O)NC3=CC=CC=C3C(F)(F)F |
Product Overview
F2563-0495 (CAS 896299-56-2), with molecular formula C18H18F3N5OS and molecular weight 409.12 g/mol. IUPAC: 2-[(5-propyl-4-pyrrol-1-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[2-(trifluoromethyl)phenyl]acetamide.
Chemical Property Profile of F2563-0495
Property Insights of F2563-0495
The XLogP value of 4.0931 indicates that F2563-0495 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 F2563-0495. Following Lipinski's Rule of Five, F2563-0495 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 F2563-0495?
The CAS number of F2563-0495 is 896299-56-2.
What is the molecular formula of F2563-0495?
The molecular formula of F2563-0495 is C18H18F3N5OS.
What is the molecular weight of F2563-0495?
The molecular weight of F2563-0495 is 409.12 g/mol.
Where can I buy F2563-0495?
You can request a quote for F2563-0495 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F2563-0495?
Yes, KEHONG BIO provides custom synthesis services for F2563-0495 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.