F0545-0308
TL;DR: F0545-0308 (CAS 681275-44-5) is a chemical compound with molecular formula C31H26FN3O2S2 and molecular weight 555.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[1-[(3-fluorophenyl)methyl]indol-3-yl]sulfanyl-1-[3-(4-methoxyphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]ethanone
Also Known As: F0545-0308, 2-((1-(3-fluorobenzyl)-1H-indol-3-yl)thio)-1-(5-(4-methoxyphenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl)ethanone, 2-({1-[(3-fluorophenyl)methyl]-1H-indol-3-yl}sulfanyl)-1-[5-(4-methoxyphenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one, 2-[1-[(3-fluorophenyl)methyl]indol-3-yl]sulfanyl-1-[3-(4-methoxyphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]ethanone
| Molecular Formula | C31H26FN3O2S2 |
|---|---|
| Molecular Weight | 555.14 g/mol |
| LogP | 7.3688 |
| Topological Polar Surface Area | 46.83 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 555.145 |
| Heavy Atoms | 39 |
| Complexity | 1644.4635 |
Chemical Identifiers
| CAS Number | 681275-44-5 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2CC(=NN2C(=O)CSC3=CN(C4=CC=CC=C43)CC5=CC(=CC=C5)F)C6=CC=CS6 |
Product Overview
F0545-0308 (CAS 681275-44-5), with molecular formula C31H26FN3O2S2 and molecular weight 555.14 g/mol. IUPAC: 2-[1-[(3-fluorophenyl)methyl]indol-3-yl]sulfanyl-1-[3-(4-methoxyphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]ethanone.
Chemical Property Profile of F0545-0308
Property Insights of F0545-0308
The XLogP value of 7.3688 indicates that F0545-0308 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.83 Ų, F0545-0308 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, F0545-0308 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0545-0308?
The CAS number of F0545-0308 is 681275-44-5.
What is the molecular formula of F0545-0308?
The molecular formula of F0545-0308 is C31H26FN3O2S2.
What is the molecular weight of F0545-0308?
The molecular weight of F0545-0308 is 555.14 g/mol.
Where can I buy F0545-0308?
You can request a quote for F0545-0308 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0545-0308?
Yes, KEHONG BIO provides custom synthesis services for F0545-0308 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.