F0554-0042
TL;DR: F0554-0042 (CAS 532969-85-0) is a chemical compound with molecular formula C23H23N5O2S3 and molecular weight 497.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-[3-[2-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl]sulfanylindol-1-yl]ethyl]benzamide
Also Known As: F0554-0042, N-(2-{3-[({[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]carbamoyl}methyl)sulfanyl]-1H-indol-1-yl}ethyl)benzamide, N-(2-(3-((2-((5-(ethylthio)-1,3,4-thiadiazol-2-yl)amino)-2-oxoethyl)thio)-1H-indol-1-yl)ethyl)benzamide, N-[2-[3-[2-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl]sulfanylindol-1-yl]ethyl]benzamide, N-[2-[3-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)carbamoylmethylsulfanyl]indol-1-yl]ethyl]benzamide
| Molecular Formula | C23H23N5O2S3 |
|---|---|
| Molecular Weight | 497.10 g/mol |
| LogP | 4.7656 |
| Topological Polar Surface Area | 88.91 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 10 |
| Exact Mass | 497.10138 |
| Heavy Atoms | 33 |
| Complexity | 1239.3743 |
Chemical Identifiers
| CAS Number | 532969-85-0 |
|---|---|
| SMILES | CCSC1=NN=C(S1)NC(=O)CSC2=CN(C3=CC=CC=C32)CCNC(=O)C4=CC=CC=C4 |
Product Overview
F0554-0042 (CAS 532969-85-0), with molecular formula C23H23N5O2S3 and molecular weight 497.10 g/mol. IUPAC: N-[2-[3-[2-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl]sulfanylindol-1-yl]ethyl]benzamide.
Chemical Property Profile of F0554-0042
Property Insights of F0554-0042
The XLogP value of 4.7656 indicates that F0554-0042 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.91 Ų falls within the moderate polarity range, balancing permeability and solubility for F0554-0042. Following Lipinski's Rule of Five, F0554-0042 has 2 hydrogen bond donor(s) and 7 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 F0554-0042?
The CAS number of F0554-0042 is 532969-85-0.
What is the molecular formula of F0554-0042?
The molecular formula of F0554-0042 is C23H23N5O2S3.
What is the molecular weight of F0554-0042?
The molecular weight of F0554-0042 is 497.10 g/mol.
Where can I buy F0554-0042?
You can request a quote for F0554-0042 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0554-0042?
Yes, KEHONG BIO provides custom synthesis services for F0554-0042 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.