F0653-0359
TL;DR: F0653-0359 (CAS 852145-25-6) is a chemical compound with molecular formula C16H18N4O3S and molecular weight 346.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[[5-(1H-indol-3-yl)-4-(2-methoxyethyl)-1,2,4-triazol-3-yl]sulfanyl]acetate
Also Known As: F0653-0359, methyl 2-((5-(1H-indol-3-yl)-4-(2-methoxyethyl)-4H-1,2,4-triazol-3-yl)thio)acetate, methyl 2-{[5-(1H-indol-3-yl)-4-(2-methoxyethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate, methyl 2-[[5-(1H-indol-3-yl)-4-(2-methoxyethyl)-1,2,4-triazol-3-yl]sulfanyl]acetate, methyl 2-[[5-indol-3-ylidene-4-(2-methoxyethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetate
| Molecular Formula | C16H18N4O3S |
|---|---|
| Molecular Weight | 346.11 g/mol |
| LogP | 2.3379 |
| Topological Polar Surface Area | 82.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 346.10995 |
| Heavy Atoms | 24 |
| Complexity | 842.8352 |
Chemical Identifiers
| CAS Number | 852145-25-6 |
|---|---|
| SMILES | COCCN1C(=NN=C1SCC(=O)OC)C2=CNC3=CC=CC=C32 |
Product Overview
F0653-0359 (CAS 852145-25-6), with molecular formula C16H18N4O3S and molecular weight 346.11 g/mol. IUPAC: methyl 2-[[5-(1H-indol-3-yl)-4-(2-methoxyethyl)-1,2,4-triazol-3-yl]sulfanyl]acetate.
Chemical Property Profile of F0653-0359
Property Insights of F0653-0359
The XLogP value of 2.3379 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F0653-0359. The TPSA of 82.03 Ų falls within the moderate polarity range, balancing permeability and solubility for F0653-0359. Following Lipinski's Rule of Five, F0653-0359 has 1 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 F0653-0359?
The CAS number of F0653-0359 is 852145-25-6.
What is the molecular formula of F0653-0359?
The molecular formula of F0653-0359 is C16H18N4O3S.
What is the molecular weight of F0653-0359?
The molecular weight of F0653-0359 is 346.11 g/mol.
Where can I buy F0653-0359?
You can request a quote for F0653-0359 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0653-0359?
Yes, KEHONG BIO provides custom synthesis services for F0653-0359 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.