F0580-0272
TL;DR: F0580-0272 (CAS 536705-19-8) is a chemical compound with molecular formula C25H19ClN4O2S and molecular weight 474.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-chlorophenyl)-2-[[3-(4-methylphenyl)-4-oxo-5H-pyrimido[5,4-b]indol-2-yl]sulfanyl]acetamide
Also Known As: F0580-0272, N-(4-chlorophenyl)-2-((4-oxo-3-(p-tolyl)-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl)thio)acetamide, N-(4-chlorophenyl)-2-{[3-(4-methylphenyl)-4-oxo-3H,4H,5H-pyrimido[5,4-b]indol-2-yl]sulfanyl}acetamide, N-(4-chlorophenyl)-2-[[3-(4-methylphenyl)-4-oxo-5H-pyrimido[5,4-b]indol-2-yl]sulfanyl]acetamide
| Molecular Formula | C25H19ClN4O2S |
|---|---|
| Molecular Weight | 474.09 g/mol |
| LogP | 5.55962 |
| Topological Polar Surface Area | 79.78 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 474.09174 |
| Heavy Atoms | 33 |
| Complexity | 1539.8394 |
Chemical Identifiers
| CAS Number | 536705-19-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C(=O)C3=C(C4=CC=CC=C4N3)N=C2SCC(=O)NC5=CC=C(C=C5)Cl |
Product Overview
F0580-0272 (CAS 536705-19-8), with molecular formula C25H19ClN4O2S and molecular weight 474.09 g/mol. IUPAC: N-(4-chlorophenyl)-2-[[3-(4-methylphenyl)-4-oxo-5H-pyrimido[5,4-b]indol-2-yl]sulfanyl]acetamide.
Chemical Property Profile of F0580-0272
Property Insights of F0580-0272
The XLogP value of 5.55962 indicates that F0580-0272 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.78 Ų falls within the moderate polarity range, balancing permeability and solubility for F0580-0272. Following Lipinski's Rule of Five, F0580-0272 has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0580-0272?
The CAS number of F0580-0272 is 536705-19-8.
What is the molecular formula of F0580-0272?
The molecular formula of F0580-0272 is C25H19ClN4O2S.
What is the molecular weight of F0580-0272?
The molecular weight of F0580-0272 is 474.09 g/mol.
Where can I buy F0580-0272?
You can request a quote for F0580-0272 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0580-0272?
Yes, KEHONG BIO provides custom synthesis services for F0580-0272 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.