F0580-0209
TL;DR: F0580-0209 (CAS 536704-56-0) is a chemical compound with molecular formula C26H22N4O2S and molecular weight 454.14636 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(4-methylphenyl)-2-[[3-(4-methylphenyl)-4-oxo-5H-pyrimido[5,4-b]indol-2-yl]sulfanyl]acetamide
Also Known As: F0580-0209, N-(4-methylphenyl)-2-{[3-(4-methylphenyl)-4-oxo-3H,4H,5H-pyrimido[5,4-b]indol-2-yl]sulfanyl}acetamide, 2-((4-oxo-3-(p-tolyl)-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl)thio)-N-(p-tolyl)acetamide, N-(4-methylphenyl)-2-[[3-(4-methylphenyl)-4-oxo-5H-pyrimido[5,4-b]indol-2-yl]sulfanyl]acetamide
Technical Specifications
| Molecular Formula | C26H22N4O2S |
| Molecular Weight | 454.14636 g/mol |
| XLogP | 5.5 |
| Topological Polar Surface Area (TPSA) | 103.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 454.14636 Da |
| Heavy Atoms | 33 |
| Complexity | 757.0 |
| SMILES | CC1=CC=C(C=C1)NC(=O)CSC2=NC3=C(C(=O)N2C4=CC=C(C=C4)C)NC5=CC=CC=C53 |
| InChIKey | JBRFSFVKWVJOKN-UHFFFAOYSA-N |
Chemical Property Profile of F0580-0209
Property Insights of F0580-0209
The XLogP value of 5.5 indicates that F0580-0209 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for F0580-0209. Following Lipinski's Rule of Five, F0580-0209 has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of F0580-0209?
The CAS number of F0580-0209 is 536704-56-0.
What is the molecular formula of F0580-0209?
The molecular formula of F0580-0209 is C26H22N4O2S.
What is the molecular weight of F0580-0209?
The molecular weight of F0580-0209 is 454.14636 g/mol.
Where can I buy F0580-0209?
You can request a quote for F0580-0209 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for F0580-0209?
Yes, CoreyChem provides custom synthesis services for F0580-0209 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.