G856-1000
TL;DR: G856-1000 (CAS 536706-55-5) is a chemical compound with molecular formula C25H18F2N4O3S and molecular weight 492.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,4-difluorophenyl)-2-[[3-(3-methoxyphenyl)-4-oxo-5H-pyrimido[5,4-b]indol-2-yl]sulfanyl]acetamide
Also Known As: G856-1000, F0580-0408, N-(2,4-difluorophenyl)-2-{[3-(3-methoxyphenyl)-4-oxo-3H,4H,5H-pyrimido[5,4-b]indol-2-yl]sulfanyl}acetamide, N-(2,4-difluorophenyl)-2-((3-(3-methoxyphenyl)-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl)thio)acetamide, N-(2,4-difluorophenyl)-2-[[3-(3-methoxyphenyl)-4-oxo-5H-pyrimido[5,4-b]indol-2-yl]sulfanyl]acetamide
| Molecular Formula | C25H18F2N4O3S |
|---|---|
| Molecular Weight | 492.11 g/mol |
| LogP | 4.8846 |
| Topological Polar Surface Area | 89.01 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 492.10678 |
| Heavy Atoms | 35 |
| Complexity | 1647.7216 |
Chemical Identifiers
| CAS Number | 536706-55-5 |
|---|---|
| SMILES | COC1=CC=CC(=C1)N2C(=O)C3=C(C4=CC=CC=C4N3)N=C2SCC(=O)NC5=C(C=C(C=C5)F)F |
Product Overview
G856-1000 (CAS 536706-55-5), with molecular formula C25H18F2N4O3S and molecular weight 492.11 g/mol. IUPAC: N-(2,4-difluorophenyl)-2-[[3-(3-methoxyphenyl)-4-oxo-5H-pyrimido[5,4-b]indol-2-yl]sulfanyl]acetamide.
Chemical Property Profile of G856-1000
Property Insights of G856-1000
The XLogP value of 4.8846 indicates that G856-1000 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 G856-1000. Following Lipinski's Rule of Five, G856-1000 has 2 hydrogen bond donor(s) and 5 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 G856-1000?
The CAS number of G856-1000 is 536706-55-5.
What is the molecular formula of G856-1000?
The molecular formula of G856-1000 is C25H18F2N4O3S.
What is the molecular weight of G856-1000?
The molecular weight of G856-1000 is 492.11 g/mol.
Where can I buy G856-1000?
You can request a quote for G856-1000 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for G856-1000?
Yes, KEHONG BIO provides custom synthesis services for G856-1000 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.