F0601-0052
TL;DR: F0601-0052 (CAS 689748-97-8) is a chemical compound with molecular formula C19H20N4O4S2 and molecular weight 432.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[4-(2-methoxyphenyl)-5-[(thiophene-2-carbonylamino)methyl]-1,2,4-triazol-3-yl]sulfanyl]acetate
Also Known As: F0601-0052, ethyl 2-((4-(2-methoxyphenyl)-5-((thiophene-2-carboxamido)methyl)-4H-1,2,4-triazol-3-yl)thio)acetate, ethyl 2-{[4-(2-methoxyphenyl)-5-{[(thiophen-2-yl)formamido]methyl}-4H-1,2,4-triazol-3-yl]sulfanyl}acetate, ethyl 2-[[4-(2-methoxyphenyl)-5-[(thiophene-2-carbonylamino)methyl]-1,2,4-triazol-3-yl]sulfanyl]acetate
| Molecular Formula | C19H20N4O4S2 |
|---|---|
| Molecular Weight | 432.09 g/mol |
| LogP | 2.9226 |
| Topological Polar Surface Area | 95.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 432.0926 |
| Heavy Atoms | 29 |
| Complexity | 972.5118 |
Chemical Identifiers
| CAS Number | 689748-97-8 |
|---|---|
| SMILES | CCOC(=O)CSC1=NN=C(N1C2=CC=CC=C2OC)CNC(=O)C3=CC=CS3 |
Product Overview
F0601-0052 (CAS 689748-97-8), with molecular formula C19H20N4O4S2 and molecular weight 432.09 g/mol. IUPAC: ethyl 2-[[4-(2-methoxyphenyl)-5-[(thiophene-2-carbonylamino)methyl]-1,2,4-triazol-3-yl]sulfanyl]acetate.
Chemical Property Profile of F0601-0052
Property Insights of F0601-0052
The XLogP value of 2.9226 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F0601-0052. The TPSA of 95.34 Ų falls within the moderate polarity range, balancing permeability and solubility for F0601-0052. Following Lipinski's Rule of Five, F0601-0052 has 1 hydrogen bond donor(s) and 8 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 F0601-0052?
The CAS number of F0601-0052 is 689748-97-8.
What is the molecular formula of F0601-0052?
The molecular formula of F0601-0052 is C19H20N4O4S2.
What is the molecular weight of F0601-0052?
The molecular weight of F0601-0052 is 432.09 g/mol.
Where can I buy F0601-0052?
You can request a quote for F0601-0052 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0601-0052?
Yes, KEHONG BIO provides custom synthesis services for F0601-0052 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.