F6548-0397
TL;DR: F6548-0397 (CAS 726155-32-4) is a chemical compound with molecular formula C16H11FN4OS and molecular weight 326.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(4-fluorophenyl)methyl]-1-sulfanylidene-2H-[1,2,4]triazolo[4,3-a]quinazolin-5-one
Also Known As: F6548-0397, 4-[(4-fluorophenyl)methyl]-1-sulfanylidene-2H-[1,2,4]triazolo[4,3-a]quinazolin-5-one, 4-(4-fluorobenzyl)-1-thioxo-1,2-dihydro-[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one, 4-(4-fluorobenzyl)-1-thioxo-2,4-dihydro[1,2,4]triazolo[4,3-a]quinazolin-5(1H)-one, 4-[(4-FLUOROPHENYL)METHYL]-1-SULFANYLIDENE-1H,2H,4H,5H-[1,2,4]TRIAZOLO[4,3-A]QUINAZOLIN-5-ONE
| Molecular Formula | C16H11FN4OS |
|---|---|
| Molecular Weight | 326.06 g/mol |
| LogP | 2.89419 |
| Topological Polar Surface Area | 55.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 326.06375 |
| Heavy Atoms | 23 |
| Complexity | 1140.8776 |
Chemical Identifiers
| CAS Number | 726155-32-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)N(C3=NNC(=S)N23)CC4=CC=C(C=C4)F |
Product Overview
F6548-0397 (CAS 726155-32-4), with molecular formula C16H11FN4OS and molecular weight 326.06 g/mol. IUPAC: 4-[(4-fluorophenyl)methyl]-1-sulfanylidene-2H-[1,2,4]triazolo[4,3-a]quinazolin-5-one.
Chemical Property Profile of F6548-0397
Property Insights of F6548-0397
The XLogP value of 2.89419 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F6548-0397. With a topological polar surface area (TPSA) of 55.09 Ų, F6548-0397 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, F6548-0397 has 1 hydrogen bond donor(s) and 3 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 F6548-0397?
The CAS number of F6548-0397 is 726155-32-4.
What is the molecular formula of F6548-0397?
The molecular formula of F6548-0397 is C16H11FN4OS.
What is the molecular weight of F6548-0397?
The molecular weight of F6548-0397 is 326.06 g/mol.
Where can I buy F6548-0397?
You can request a quote for F6548-0397 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F6548-0397?
Yes, KEHONG BIO provides custom synthesis services for F6548-0397 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.