G856-0941
TL;DR: G856-0941 (CAS 536705-51-8) is a chemical compound with molecular formula C27H24N4O2S and molecular weight 468.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[3-(3,5-dimethylphenyl)-4-oxo-5H-pyrimido[5,4-b]indol-2-yl]sulfanyl]-N-(3-methylphenyl)acetamide
Also Known As: G856-0941, 2-{[3-(3,5-dimethylphenyl)-4-oxo-3H,4H,5H-pyrimido[5,4-b]indol-2-yl]sulfanyl}-N-(3-methylphenyl)acetamide, F0580-0304, 2-((3-(3,5-dimethylphenyl)-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl)thio)-N-(m-tolyl)acetamide, 2-[[3-(3,5-dimethylphenyl)-4-oxo-5H-pyrimido[5,4-b]indol-2-yl]sulfanyl]-N-(3-methylphenyl)acetamide
| Molecular Formula | C27H24N4O2S |
|---|---|
| Molecular Weight | 468.16 g/mol |
| LogP | 5.52306 |
| Topological Polar Surface Area | 79.78 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 468.162 |
| Heavy Atoms | 34 |
| Complexity | 1596.6459 |
Chemical Identifiers
| CAS Number | 536705-51-8 |
|---|---|
| SMILES | CC1=CC(=CC=C1)NC(=O)CSC2=NC3=C(C(=O)N2C4=CC(=CC(=C4)C)C)NC5=CC=CC=C53 |
Product Overview
G856-0941 (CAS 536705-51-8), with molecular formula C27H24N4O2S and molecular weight 468.16 g/mol. IUPAC: 2-[[3-(3,5-dimethylphenyl)-4-oxo-5H-pyrimido[5,4-b]indol-2-yl]sulfanyl]-N-(3-methylphenyl)acetamide.
Chemical Property Profile of G856-0941
Property Insights of G856-0941
The XLogP value of 5.52306 indicates that G856-0941 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 G856-0941. Following Lipinski's Rule of Five, G856-0941 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 G856-0941?
The CAS number of G856-0941 is 536705-51-8.
What is the molecular formula of G856-0941?
The molecular formula of G856-0941 is C27H24N4O2S.
What is the molecular weight of G856-0941?
The molecular weight of G856-0941 is 468.16 g/mol.
Where can I buy G856-0941?
You can request a quote for G856-0941 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for G856-0941?
Yes, KEHONG BIO provides custom synthesis services for G856-0941 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.