G856-0831
TL;DR: G856-0831 (CAS 536703-65-8) is a chemical compound with molecular formula C26H22N4O2S and molecular weight 454.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,4-dimethylphenyl)-2-[(4-oxo-3-phenyl-5H-pyrimido[5,4-b]indol-2-yl)sulfanyl]acetamide
Also Known As: G856-0831, F0580-0120, N-(2,4-dimethylphenyl)-2-((4-oxo-3-phenyl-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl)thio)acetamide, N-(2,4-dimethylphenyl)-2-({4-oxo-3-phenyl-3H,4H,5H-pyrimido[5,4-b]indol-2-yl}sulfanyl)acetamide, N-(2,4-dimethylphenyl)-2-[(4-oxo-3-phenyl-5H-pyrimido[5,4-b]indol-2-yl)sulfanyl]acetamide
| Molecular Formula | C26H22N4O2S |
|---|---|
| Molecular Weight | 454.15 g/mol |
| LogP | 5.21464 |
| Topological Polar Surface Area | 79.78 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 454.14636 |
| Heavy Atoms | 33 |
| Complexity | 1553.9742 |
Chemical Identifiers
| CAS Number | 536703-65-8 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)NC(=O)CSC2=NC3=C(C(=O)N2C4=CC=CC=C4)NC5=CC=CC=C53)C |
Product Overview
G856-0831 (CAS 536703-65-8), with molecular formula C26H22N4O2S and molecular weight 454.15 g/mol. IUPAC: N-(2,4-dimethylphenyl)-2-[(4-oxo-3-phenyl-5H-pyrimido[5,4-b]indol-2-yl)sulfanyl]acetamide.
Chemical Property Profile of G856-0831
Property Insights of G856-0831
The XLogP value of 5.21464 indicates that G856-0831 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 G856-0831. Following Lipinski's Rule of Five, G856-0831 has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of G856-0831?
The CAS number of G856-0831 is 536703-65-8.
What is the molecular formula of G856-0831?
The molecular formula of G856-0831 is C26H22N4O2S.
What is the molecular weight of G856-0831?
The molecular weight of G856-0831 is 454.15 g/mol.
Where can I buy G856-0831?
You can request a quote for G856-0831 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for G856-0831?
Yes, KEHONG BIO provides custom synthesis services for G856-0831 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.