F0507-1981
TL;DR: F0507-1981 (CAS 391917-18-3) is a chemical compound with molecular formula C21H24N4OS and molecular weight 380.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-tert-butyl-N-[(5-methylsulfanyl-4-phenyl-1,2,4-triazol-3-yl)methyl]benzamide
Also Known As: F0507-1981, 4-(tert-butyl)-N-((5-(methylthio)-4-phenyl-4H-1,2,4-triazol-3-yl)methyl)benzamide, 4-tert-butyl-N-{[5-(methylsulfanyl)-4-phenyl-4H-1,2,4-triazol-3-yl]methyl}benzamide, 4-tert-butyl-N-[(5-methylsulfanyl-4-phenyl-1,2,4-triazol-3-yl)methyl]benzamide
| Molecular Formula | C21H24N4OS |
|---|---|
| Molecular Weight | 380.17 g/mol |
| LogP | 4.2167 |
| Topological Polar Surface Area | 59.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 380.16708 |
| Heavy Atoms | 27 |
| Complexity | 911.60474 |
Chemical Identifiers
| CAS Number | 391917-18-3 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)C(=O)NCC2=NN=C(N2C3=CC=CC=C3)SC |
Product Overview
F0507-1981 (CAS 391917-18-3), with molecular formula C21H24N4OS and molecular weight 380.17 g/mol. IUPAC: 4-tert-butyl-N-[(5-methylsulfanyl-4-phenyl-1,2,4-triazol-3-yl)methyl]benzamide.
Chemical Property Profile of F0507-1981
Property Insights of F0507-1981
The XLogP value of 4.2167 indicates that F0507-1981 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.81 Ų, F0507-1981 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, F0507-1981 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 F0507-1981?
The CAS number of F0507-1981 is 391917-18-3.
What is the molecular formula of F0507-1981?
The molecular formula of F0507-1981 is C21H24N4OS.
What is the molecular weight of F0507-1981?
The molecular weight of F0507-1981 is 380.17 g/mol.
Where can I buy F0507-1981?
You can request a quote for F0507-1981 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0507-1981?
Yes, KEHONG BIO provides custom synthesis services for F0507-1981 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.