F0653-0287
TL;DR: F0653-0287 (CAS 852144-70-8) is a chemical compound with molecular formula C21H20BrN5O2S and molecular weight 485.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-bromophenyl)-2-[[5-(1H-indol-3-yl)-4-(2-methoxyethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: F0653-0287, 2-((5-(1H-indol-3-yl)-4-(2-methoxyethyl)-4H-1,2,4-triazol-3-yl)thio)-N-(4-bromophenyl)acetamide, N-(4-bromophenyl)-2-{[5-(1H-indol-3-yl)-4-(2-methoxyethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide, N-(4-bromophenyl)-2-[[(5Z)-5-indol-3-ylidene-4-(2-methoxyethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide, N-(4-bromophenyl)-2-[[5-(1H-indol-3-yl)-4-(2-methoxyethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
| Molecular Formula | C21H20BrN5O2S |
|---|---|
| Molecular Weight | 485.05 g/mol |
| LogP | 4.5661 |
| Topological Polar Surface Area | 84.83 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 485.05212 |
| Heavy Atoms | 30 |
| Complexity | 1155.8906 |
Chemical Identifiers
| CAS Number | 852144-70-8 |
|---|---|
| SMILES | COCCN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)Br)C3=CNC4=CC=CC=C43 |
Product Overview
F0653-0287 (CAS 852144-70-8), with molecular formula C21H20BrN5O2S and molecular weight 485.05 g/mol. IUPAC: N-(4-bromophenyl)-2-[[5-(1H-indol-3-yl)-4-(2-methoxyethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide.
Chemical Property Profile of F0653-0287
Property Insights of F0653-0287
The XLogP value of 4.5661 indicates that F0653-0287 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.83 Ų falls within the moderate polarity range, balancing permeability and solubility for F0653-0287. Following Lipinski's Rule of Five, F0653-0287 has 2 hydrogen bond donor(s) and 5 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 F0653-0287?
The CAS number of F0653-0287 is 852144-70-8.
What is the molecular formula of F0653-0287?
The molecular formula of F0653-0287 is C21H20BrN5O2S.
What is the molecular weight of F0653-0287?
The molecular weight of F0653-0287 is 485.05 g/mol.
Where can I buy F0653-0287?
You can request a quote for F0653-0287 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0653-0287?
Yes, KEHONG BIO provides custom synthesis services for F0653-0287 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.