F0580-0602
TL;DR: F0580-0602 (CAS 536708-49-3) is a chemical compound with molecular formula C23H19N5O3S2 and molecular weight 477.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[3-(4-ethoxyphenyl)-4-oxo-5H-pyrimido[5,4-b]indol-2-yl]sulfanyl]-N-(1,3-thiazol-2-yl)acetamide
Also Known As: F0580-0602, 2-((3-(4-ethoxyphenyl)-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl)thio)-N-(thiazol-2-yl)acetamide, 2-[[3-(4-ethoxyphenyl)-4-oxo-5H-pyrimido[5,4-b]indol-2-yl]sulfanyl]-N-(1,3-thiazol-2-yl)acetamide, 2-{[3-(4-ETHOXYPHENYL)-4-OXO-3H,4H,5H-PYRIMIDO[5,4-B]INDOL-2-YL]SULFANYL}-N-(1,3-THIAZOL-2-YL)ACETAMIDE
| Molecular Formula | C23H19N5O3S2 |
|---|---|
| Molecular Weight | 477.09 g/mol |
| LogP | 4.453 |
| Topological Polar Surface Area | 101.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 477.09293 |
| Heavy Atoms | 33 |
| Complexity | 1490.9058 |
Chemical Identifiers
| CAS Number | 536708-49-3 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)N2C(=O)C3=C(C4=CC=CC=C4N3)N=C2SCC(=O)NC5=NC=CS5 |
Product Overview
F0580-0602 (CAS 536708-49-3), with molecular formula C23H19N5O3S2 and molecular weight 477.09 g/mol. IUPAC: 2-[[3-(4-ethoxyphenyl)-4-oxo-5H-pyrimido[5,4-b]indol-2-yl]sulfanyl]-N-(1,3-thiazol-2-yl)acetamide.
Chemical Property Profile of F0580-0602
Property Insights of F0580-0602
The XLogP value of 4.453 indicates that F0580-0602 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.9 Ų falls within the moderate polarity range, balancing permeability and solubility for F0580-0602. Following Lipinski's Rule of Five, F0580-0602 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 F0580-0602?
The CAS number of F0580-0602 is 536708-49-3.
What is the molecular formula of F0580-0602?
The molecular formula of F0580-0602 is C23H19N5O3S2.
What is the molecular weight of F0580-0602?
The molecular weight of F0580-0602 is 477.09 g/mol.
Where can I buy F0580-0602?
You can request a quote for F0580-0602 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0580-0602?
Yes, KEHONG BIO provides custom synthesis services for F0580-0602 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.