F0653-0521
TL;DR: F0653-0521 (CAS 852145-68-7) is a chemical compound with molecular formula C26H21N5O4S and molecular weight 499.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzodioxol-5-yl)-2-[[5-(1H-indol-3-yl)-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: F0653-0521, N-(2H-1,3-benzodioxol-5-yl)-2-{[5-(1H-indol-3-yl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide, 2-((5-(1H-indol-3-yl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl)thio)-N-(benzo[d][1,3]dioxol-5-yl)acetamide, N-(1,3-benzodioxol-5-yl)-2-[[5-(1H-indol-3-yl)-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide, N-(1,3-benzodioxol-5-yl)-2-[[5-indol-3-ylidene-4-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide
| Molecular Formula | C26H21N5O4S |
|---|---|
| Molecular Weight | 499.13 g/mol |
| LogP | 4.8837 |
| Topological Polar Surface Area | 103.29 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 499.13144 |
| Heavy Atoms | 36 |
| Complexity | 1560.671 |
Chemical Identifiers
| CAS Number | 852145-68-7 |
|---|---|
| SMILES | COC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=CC4=C(C=C3)OCO4)C5=CNC6=CC=CC=C65 |
Product Overview
F0653-0521 (CAS 852145-68-7), with molecular formula C26H21N5O4S and molecular weight 499.13 g/mol. IUPAC: N-(1,3-benzodioxol-5-yl)-2-[[5-(1H-indol-3-yl)-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide.
Chemical Property Profile of F0653-0521
Property Insights of F0653-0521
The XLogP value of 4.8837 indicates that F0653-0521 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 103.29 Ų falls within the moderate polarity range, balancing permeability and solubility for F0653-0521. Following Lipinski's Rule of Five, F0653-0521 has 2 hydrogen bond donor(s) and 7 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 F0653-0521?
The CAS number of F0653-0521 is 852145-68-7.
What is the molecular formula of F0653-0521?
The molecular formula of F0653-0521 is C26H21N5O4S.
What is the molecular weight of F0653-0521?
The molecular weight of F0653-0521 is 499.13 g/mol.
Where can I buy F0653-0521?
You can request a quote for F0653-0521 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0653-0521?
Yes, KEHONG BIO provides custom synthesis services for F0653-0521 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.