G856-1092
TL;DR: G856-1092 (CAS 536708-30-2) is a chemical compound with molecular formula C26H21FN4O3S and molecular weight 488.13 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-(4-fluorophenyl)acetamide
Also Known As: G856-1092, 2-{[3-(4-ethoxyphenyl)-4-oxo-3H,4H,5H-pyrimido[5,4-b]indol-2-yl]sulfanyl}-N-(4-fluorophenyl)acetamide, F0580-0583, 2-((3-(4-ethoxyphenyl)-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl)thio)-N-(4-fluorophenyl)acetamide, 2-[[3-(4-ethoxyphenyl)-4-oxo-5H-pyrimido[5,4-b]indol-2-yl]sulfanyl]-N-(4-fluorophenyl)acetamide
| Molecular Formula | C26H21FN4O3S |
|---|---|
| Molecular Weight | 488.13 g/mol |
| LogP | 5.1356 |
| Topological Polar Surface Area | 89.01 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 488.13184 |
| Heavy Atoms | 35 |
| Complexity | 1577.3975 |
Chemical Identifiers
| CAS Number | 536708-30-2 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)N2C(=O)C3=C(C4=CC=CC=C4N3)N=C2SCC(=O)NC5=CC=C(C=C5)F |
Product Overview
G856-1092 (CAS 536708-30-2), with molecular formula C26H21FN4O3S and molecular weight 488.13 g/mol. IUPAC: 2-[[3-(4-ethoxyphenyl)-4-oxo-5H-pyrimido[5,4-b]indol-2-yl]sulfanyl]-N-(4-fluorophenyl)acetamide.
Chemical Property Profile of G856-1092
Property Insights of G856-1092
The XLogP value of 5.1356 indicates that G856-1092 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.01 Ų falls within the moderate polarity range, balancing permeability and solubility for G856-1092. Following Lipinski's Rule of Five, G856-1092 has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of G856-1092?
The CAS number of G856-1092 is 536708-30-2.
What is the molecular formula of G856-1092?
The molecular formula of G856-1092 is C26H21FN4O3S.
What is the molecular weight of G856-1092?
The molecular weight of G856-1092 is 488.13 g/mol.
Where can I buy G856-1092?
You can request a quote for G856-1092 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for G856-1092?
Yes, KEHONG BIO provides custom synthesis services for G856-1092 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.