F0653-0333
TL;DR: F0653-0333 (CAS 852145-12-1) is a chemical compound with molecular formula C25H27N5O4S2 and molecular weight 525.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[2-[[5-(1H-indol-3-yl)-4-(2-methoxyethyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Also Known As: F0653-0333, ethyl 2-(2-((5-(1H-indol-3-yl)-4-(2-methoxyethyl)-4H-1,2,4-triazol-3-yl)thio)acetamido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate, ethyl 2-(2-{[5-(1H-indol-3-yl)-4-(2-methoxyethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamido)-4H,5H,6H-cyclopenta[b]thiophene-3-carboxylate, ethyl 2-[[2-[[(5Z)-5-indol-3-ylidene-4-(2-methoxyethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate, ethyl 2-[[2-[[5-(1H-indol-3-yl)-4-(2-methoxyethyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
| Molecular Formula | C25H27N5O4S2 |
|---|---|
| Molecular Weight | 525.15 g/mol |
| LogP | 4.5305 |
| Topological Polar Surface Area | 111.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 525.15045 |
| Heavy Atoms | 36 |
| Complexity | 1406.8466 |
Chemical Identifiers
| CAS Number | 852145-12-1 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CCC2)NC(=O)CSC3=NN=C(N3CCOC)C4=CNC5=CC=CC=C54 |
Product Overview
F0653-0333 (CAS 852145-12-1), with molecular formula C25H27N5O4S2 and molecular weight 525.15 g/mol. IUPAC: ethyl 2-[[2-[[5-(1H-indol-3-yl)-4-(2-methoxyethyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate.
Chemical Property Profile of F0653-0333
Property Insights of F0653-0333
The XLogP value of 4.5305 indicates that F0653-0333 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 111.13 Ų falls within the moderate polarity range, balancing permeability and solubility for F0653-0333. Following Lipinski's Rule of Five, F0653-0333 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 F0653-0333?
The CAS number of F0653-0333 is 852145-12-1.
What is the molecular formula of F0653-0333?
The molecular formula of F0653-0333 is C25H27N5O4S2.
What is the molecular weight of F0653-0333?
The molecular weight of F0653-0333 is 525.15 g/mol.
Where can I buy F0653-0333?
You can request a quote for F0653-0333 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0653-0333?
Yes, KEHONG BIO provides custom synthesis services for F0653-0333 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.