F0554-0491
TL;DR: F0554-0491 (CAS 532973-68-5) is a chemical compound with molecular formula C27H24N4O6S and molecular weight 532.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-[3-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxoethyl]sulfanylindol-1-yl]ethyl]-4-nitrobenzamide
Also Known As: F0554-0491, N-{2-[3-({[(2,3-dihydro-1,4-benzodioxin-6-yl)carbamoyl]methyl}sulfanyl)-1H-indol-1-yl]ethyl}-4-nitrobenzamide, N-(2-(3-((2-((2,3-dihydrobenzo[b][1,4]dioxin-6-yl)amino)-2-oxoethyl)thio)-1H-indol-1-yl)ethyl)-4-nitrobenzamide, N-[2-[3-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxoethyl]sulfanylindol-1-yl]ethyl]-4-nitrobenzamide, N-(2-{3-[(N-2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)methylthio]-1-indolyl}ethyl)p-nitrobenzamide
| Molecular Formula | C27H24N4O6S |
|---|---|
| Molecular Weight | 532.14 g/mol |
| LogP | 4.4815 |
| Topological Polar Surface Area | 124.73 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 532.14166 |
| Heavy Atoms | 38 |
| Complexity | 1501.4875 |
Chemical Identifiers
| CAS Number | 532973-68-5 |
|---|---|
| SMILES | C1COC2=C(O1)C=CC(=C2)NC(=O)CSC3=CN(C4=CC=CC=C43)CCNC(=O)C5=CC=C(C=C5)[N+](=O)[O-] |
Product Overview
F0554-0491 (CAS 532973-68-5), with molecular formula C27H24N4O6S and molecular weight 532.14 g/mol. IUPAC: N-[2-[3-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxoethyl]sulfanylindol-1-yl]ethyl]-4-nitrobenzamide.
Chemical Property Profile of F0554-0491
Property Insights of F0554-0491
The XLogP value of 4.4815 indicates that F0554-0491 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 124.73 Ų falls within the moderate polarity range, balancing permeability and solubility for F0554-0491. Following Lipinski's Rule of Five, F0554-0491 has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0554-0491?
The CAS number of F0554-0491 is 532973-68-5.
What is the molecular formula of F0554-0491?
The molecular formula of F0554-0491 is C27H24N4O6S.
What is the molecular weight of F0554-0491?
The molecular weight of F0554-0491 is 532.14 g/mol.
Where can I buy F0554-0491?
You can request a quote for F0554-0491 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0554-0491?
Yes, KEHONG BIO provides custom synthesis services for F0554-0491 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.