F0554-0501
TL;DR: F0554-0501 (CAS 532973-79-8) is a chemical compound with molecular formula C30H30N4O6S2 and molecular weight 606.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[2-[1-[2-[(4-nitrobenzoyl)amino]ethyl]indol-3-yl]sulfanylacetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Also Known As: F0554-0501, ethyl 2-(2-((1-(2-(4-nitrobenzamido)ethyl)-1H-indol-3-yl)thio)acetamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate, ethyl 2-[[2-[1-[2-[(4-nitrobenzoyl)amino]ethyl]indol-3-yl]sulfanylacetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, ethyl 2-{2-[(1-{2-[(4-nitrophenyl)formamido]ethyl}-1H-indol-3-yl)sulfanyl]acetamido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
| Molecular Formula | C30H30N4O6S2 |
|---|---|
| Molecular Weight | 606.16 g/mol |
| LogP | 5.8273 |
| Topological Polar Surface Area | 132.57 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 11 |
| Exact Mass | 606.1607 |
| Heavy Atoms | 42 |
| Complexity | 1643.4459 |
Chemical Identifiers
| CAS Number | 532973-79-8 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)CSC3=CN(C4=CC=CC=C43)CCNC(=O)C5=CC=C(C=C5)[N+](=O)[O-] |
Product Overview
F0554-0501 (CAS 532973-79-8), with molecular formula C30H30N4O6S2 and molecular weight 606.16 g/mol. IUPAC: ethyl 2-[[2-[1-[2-[(4-nitrobenzoyl)amino]ethyl]indol-3-yl]sulfanylacetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate.
Chemical Property Profile of F0554-0501
Property Insights of F0554-0501
The XLogP value of 5.8273 indicates that F0554-0501 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 132.57 Ų falls within the moderate polarity range, balancing permeability and solubility for F0554-0501. Following Lipinski's Rule of Five, F0554-0501 has 2 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 F0554-0501?
The CAS number of F0554-0501 is 532973-79-8.
What is the molecular formula of F0554-0501?
The molecular formula of F0554-0501 is C30H30N4O6S2.
What is the molecular weight of F0554-0501?
The molecular weight of F0554-0501 is 606.16 g/mol.
Where can I buy F0554-0501?
You can request a quote for F0554-0501 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0554-0501?
Yes, KEHONG BIO provides custom synthesis services for F0554-0501 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.