F0580-0671
TL;DR: F0580-0671 (CAS 536710-82-4) is a chemical compound with molecular formula C22H17FN6O2S2 and molecular weight 480.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-[[3-(4-fluorophenyl)-4-oxo-5H-pyrimido[5,4-b]indol-2-yl]sulfanyl]acetamide
Also Known As: F0580-0671, G856-1137, N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-{[3-(4-fluorophenyl)-4-oxo-3H,4H,5H-pyrimido[5,4-b]indol-2-yl]sulfanyl}acetamide, N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-((3-(4-fluorophenyl)-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl)thio)acetamide, N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-[[3-(4-fluorophenyl)-4-oxo-5H-pyrimido[5,4-b]indol-2-yl]sulfanyl]acetamide
| Molecular Formula | C22H17FN6O2S2 |
|---|---|
| Molecular Weight | 480.08 g/mol |
| LogP | 4.1508 |
| Topological Polar Surface Area | 105.56 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 480.08383 |
| Heavy Atoms | 33 |
| Complexity | 1540.6302 |
Chemical Identifiers
| CAS Number | 536710-82-4 |
|---|---|
| SMILES | CCC1=NN=C(S1)NC(=O)CSC2=NC3=C(C(=O)N2C4=CC=C(C=C4)F)NC5=CC=CC=C53 |
Product Overview
F0580-0671 (CAS 536710-82-4), with molecular formula C22H17FN6O2S2 and molecular weight 480.08 g/mol. IUPAC: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-[[3-(4-fluorophenyl)-4-oxo-5H-pyrimido[5,4-b]indol-2-yl]sulfanyl]acetamide.
Chemical Property Profile of F0580-0671
Property Insights of F0580-0671
The XLogP value of 4.1508 indicates that F0580-0671 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 105.56 Ų falls within the moderate polarity range, balancing permeability and solubility for F0580-0671. Following Lipinski's Rule of Five, F0580-0671 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 F0580-0671?
The CAS number of F0580-0671 is 536710-82-4.
What is the molecular formula of F0580-0671?
The molecular formula of F0580-0671 is C22H17FN6O2S2.
What is the molecular weight of F0580-0671?
The molecular weight of F0580-0671 is 480.08 g/mol.
Where can I buy F0580-0671?
You can request a quote for F0580-0671 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0580-0671?
Yes, KEHONG BIO provides custom synthesis services for F0580-0671 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.