F0554-0874
TL;DR: F0554-0874 (CAS 533865-99-5) is a chemical compound with molecular formula C26H28F2N4O4S and molecular weight 530.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[2-[1-[2-[(2,6-difluorobenzoyl)amino]ethyl]indol-3-yl]sulfanylacetyl]piperazine-1-carboxylate
Also Known As: F0554-0874, ethyl 4-(2-((1-(2-(2,6-difluorobenzamido)ethyl)-1H-indol-3-yl)thio)acetyl)piperazine-1-carboxylate, ethyl 4-{2-[(1-{2-[(2,6-difluorophenyl)formamido]ethyl}-1H-indol-3-yl)sulfanyl]acetyl}piperazine-1-carboxylate, ethyl 4-[2-[1-[2-[(2,6-difluorobenzoyl)amino]ethyl]indol-3-yl]sulfanylacetyl]piperazine-1-carboxylate, ethyl 4-(2-{1-[2-(2,6-difluorobenzylamino)ethyl]-3-indolylthio}acetyl)-1-piperazinecarboxylate
| Molecular Formula | C26H28F2N4O4S |
|---|---|
| Molecular Weight | 530.18 g/mol |
| LogP | 3.7423 |
| Topological Polar Surface Area | 83.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 530.17993 |
| Heavy Atoms | 37 |
| Complexity | 1270.5674 |
Chemical Identifiers
| CAS Number | 533865-99-5 |
|---|---|
| SMILES | CCOC(=O)N1CCN(CC1)C(=O)CSC2=CN(C3=CC=CC=C32)CCNC(=O)C4=C(C=CC=C4F)F |
Product Overview
F0554-0874 (CAS 533865-99-5), with molecular formula C26H28F2N4O4S and molecular weight 530.18 g/mol. IUPAC: ethyl 4-[2-[1-[2-[(2,6-difluorobenzoyl)amino]ethyl]indol-3-yl]sulfanylacetyl]piperazine-1-carboxylate.
Chemical Property Profile of F0554-0874
Property Insights of F0554-0874
The XLogP value of 3.7423 indicates that F0554-0874 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.88 Ų falls within the moderate polarity range, balancing permeability and solubility for F0554-0874. Following Lipinski's Rule of Five, F0554-0874 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0554-0874?
The CAS number of F0554-0874 is 533865-99-5.
What is the molecular formula of F0554-0874?
The molecular formula of F0554-0874 is C26H28F2N4O4S.
What is the molecular weight of F0554-0874?
The molecular weight of F0554-0874 is 530.18 g/mol.
Where can I buy F0554-0874?
You can request a quote for F0554-0874 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0554-0874?
Yes, KEHONG BIO provides custom synthesis services for F0554-0874 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.