F3394-0537
TL;DR: F3394-0537 (CAS 671199-72-7) is a chemical compound with molecular formula C27H24N4O3S3 and molecular weight 548.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(3,4-dimethylphenyl)-2-[[2-[(5-phenyl-[1,3]thiazolo[2,3-c][1,2,4]triazol-3-yl)sulfanyl]acetyl]amino]thiophene-3-carboxylate
Also Known As: F3394-0537, ETHYL 4-(3,4-DIMETHYLPHENYL)-2-[2-({5-PHENYL-[1,2,4]TRIAZOLO[3,4-B][1,3]THIAZOL-3-YL}SULFANYL)ACETAMIDO]THIOPHENE-3-CARBOXYLATE, ethyl 4-(3,4-dimethylphenyl)-2-(2-((5-phenylthiazolo[2,3-c][1,2,4]triazol-3-yl)thio)acetamido)thiophene-3-carboxylate, ethyl 4-(3,4-dimethylphenyl)-2-[[2-[(5-phenyl-[1,3]thiazolo[2,3-c][1,2,4]triazol-3-yl)sulfanyl]acetyl]amino]thiophene-3-carboxylate, ethyl 2-{[(8-phenyl-6-thia-1,3,4-triazabicyclo[3.3.0]octa-2,4,7-trien-2-ylthio)methyl]carbonylamino}-4-(3,4-xylyl)-3-thenoate
| Molecular Formula | C27H24N4O3S3 |
|---|---|
| Molecular Weight | 548.10 g/mol |
| LogP | 6.71064 |
| Topological Polar Surface Area | 85.59 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 548.1011 |
| Heavy Atoms | 37 |
| Complexity | 1587.2397 |
Chemical Identifiers
| CAS Number | 671199-72-7 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC=C1C2=CC(=C(C=C2)C)C)NC(=O)CSC3=NN=C4N3C(=CS4)C5=CC=CC=C5 |
Product Overview
F3394-0537 (CAS 671199-72-7), with molecular formula C27H24N4O3S3 and molecular weight 548.10 g/mol. IUPAC: ethyl 4-(3,4-dimethylphenyl)-2-[[2-[(5-phenyl-[1,3]thiazolo[2,3-c][1,2,4]triazol-3-yl)sulfanyl]acetyl]amino]thiophene-3-carboxylate.
Chemical Property Profile of F3394-0537
Property Insights of F3394-0537
The XLogP value of 6.71064 indicates that F3394-0537 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.59 Ų falls within the moderate polarity range, balancing permeability and solubility for F3394-0537. Following Lipinski's Rule of Five, F3394-0537 has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F3394-0537?
The CAS number of F3394-0537 is 671199-72-7.
What is the molecular formula of F3394-0537?
The molecular formula of F3394-0537 is C27H24N4O3S3.
What is the molecular weight of F3394-0537?
The molecular weight of F3394-0537 is 548.10 g/mol.
Where can I buy F3394-0537?
You can request a quote for F3394-0537 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F3394-0537?
Yes, KEHONG BIO provides custom synthesis services for F3394-0537 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.