G856-1162
TL;DR: G856-1162 (CAS 536711-48-5) is a chemical compound with molecular formula C25H19FN4O2S and molecular weight 458.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzyl-2-[[3-(4-fluorophenyl)-4-oxo-5H-pyrimido[5,4-b]indol-2-yl]sulfanyl]acetamide
Also Known As: G856-1162, N-benzyl-2-{[3-(4-fluorophenyl)-4-oxo-3H,4H,5H-pyrimido[5,4-b]indol-2-yl]sulfanyl}acetamide, F0580-0707, N-benzyl-2-[[3-(4-fluorophenyl)-4-oxo-5H-pyrimido[5,4-b]indol-2-yl]sulfanyl]acetamide, N-benzyl-2-((3-(4-fluorophenyl)-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl)thio)acetamide
| Molecular Formula | C25H19FN4O2S |
|---|---|
| Molecular Weight | 458.12 g/mol |
| LogP | 4.4146 |
| Topological Polar Surface Area | 79.78 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 458.12128 |
| Heavy Atoms | 33 |
| Complexity | 1511.3236 |
Chemical Identifiers
| CAS Number | 536711-48-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)CNC(=O)CSC2=NC3=C(C(=O)N2C4=CC=C(C=C4)F)NC5=CC=CC=C53 |
Product Overview
G856-1162 (CAS 536711-48-5), with molecular formula C25H19FN4O2S and molecular weight 458.12 g/mol. IUPAC: N-benzyl-2-[[3-(4-fluorophenyl)-4-oxo-5H-pyrimido[5,4-b]indol-2-yl]sulfanyl]acetamide.
Chemical Property Profile of G856-1162
Property Insights of G856-1162
The XLogP value of 4.4146 indicates that G856-1162 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 G856-1162. Following Lipinski's Rule of Five, G856-1162 has 2 hydrogen bond donor(s) and 4 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 G856-1162?
The CAS number of G856-1162 is 536711-48-5.
What is the molecular formula of G856-1162?
The molecular formula of G856-1162 is C25H19FN4O2S.
What is the molecular weight of G856-1162?
The molecular weight of G856-1162 is 458.12 g/mol.
Where can I buy G856-1162?
You can request a quote for G856-1162 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for G856-1162?
Yes, KEHONG BIO provides custom synthesis services for G856-1162 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.