F0653-0736
TL;DR: F0653-0736 (CAS 731817-30-4) is a chemical compound with molecular formula C25H27N5O3S and molecular weight 477.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-(4-ethoxyphenyl)-5-(1H-indol-3-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-(oxolan-2-ylmethyl)acetamide
Also Known As: F0653-0736, 2-((4-(4-ethoxyphenyl)-5-(1H-indol-3-yl)-4H-1,2,4-triazol-3-yl)thio)-N-((tetrahydrofuran-2-yl)methyl)acetamide, 2-{[4-(4-ethoxyphenyl)-5-(1H-indol-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[(oxolan-2-yl)methyl]acetamide, 2-[[4-(4-ethoxyphenyl)-5-(1H-indol-3-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-(oxolan-2-ylmethyl)acetamide, 2-[[4-(4-ethoxyphenyl)-5-indol-3-ylidene-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(oxolan-2-ylmethyl)acetamide
| Molecular Formula | C25H27N5O3S |
|---|---|
| Molecular Weight | 477.18 g/mol |
| LogP | 4.2016 |
| Topological Polar Surface Area | 94.06 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 477.18347 |
| Heavy Atoms | 34 |
| Complexity | 1261.2958 |
Chemical Identifiers
| CAS Number | 731817-30-4 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NCC3CCCO3)C4=CNC5=CC=CC=C54 |
Product Overview
F0653-0736 (CAS 731817-30-4), with molecular formula C25H27N5O3S and molecular weight 477.18 g/mol. IUPAC: 2-[[4-(4-ethoxyphenyl)-5-(1H-indol-3-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-(oxolan-2-ylmethyl)acetamide.
Chemical Property Profile of F0653-0736
Property Insights of F0653-0736
The XLogP value of 4.2016 indicates that F0653-0736 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.06 Ų falls within the moderate polarity range, balancing permeability and solubility for F0653-0736. Following Lipinski's Rule of Five, F0653-0736 has 2 hydrogen bond donor(s) and 6 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 F0653-0736?
The CAS number of F0653-0736 is 731817-30-4.
What is the molecular formula of F0653-0736?
The molecular formula of F0653-0736 is C25H27N5O3S.
What is the molecular weight of F0653-0736?
The molecular weight of F0653-0736 is 477.18 g/mol.
Where can I buy F0653-0736?
You can request a quote for F0653-0736 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0653-0736?
Yes, KEHONG BIO provides custom synthesis services for F0653-0736 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.