G856-1285
TL;DR: G856-1285 (CAS 536715-64-7) is a chemical compound with molecular formula C23H19F3N4O2S and molecular weight 472.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanyl-3-[3-(trifluoromethyl)phenyl]-5H-pyrimido[5,4-b]indol-4-one
Also Known As: G856-1285, 2-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}-3-[3-(trifluoromethyl)phenyl]-3H,4H,5H-pyrimido[5,4-b]indol-4-one, F0580-0941, 2-((2-oxo-2-(pyrrolidin-1-yl)ethyl)thio)-3-(3-(trifluoromethyl)phenyl)-3H-pyrimido[5,4-b]indol-4(5H)-one, 2-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanyl-3-[3-(trifluoromethyl)phenyl]-5H-pyrimido[5,4-b]indol-4-one
| Molecular Formula | C23H19F3N4O2S |
|---|---|
| Molecular Weight | 472.12 g/mol |
| LogP | 4.6003 |
| Topological Polar Surface Area | 70.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 472.11807 |
| Heavy Atoms | 33 |
| Complexity | 1421.0074 |
Chemical Identifiers
| CAS Number | 536715-64-7 |
|---|---|
| SMILES | C1CCN(C1)C(=O)CSC2=NC3=C(C(=O)N2C4=CC=CC(=C4)C(F)(F)F)NC5=CC=CC=C53 |
Product Overview
G856-1285 (CAS 536715-64-7), with molecular formula C23H19F3N4O2S and molecular weight 472.12 g/mol. IUPAC: 2-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanyl-3-[3-(trifluoromethyl)phenyl]-5H-pyrimido[5,4-b]indol-4-one.
Chemical Property Profile of G856-1285
Property Insights of G856-1285
The XLogP value of 4.6003 indicates that G856-1285 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.99 Ų falls within the moderate polarity range, balancing permeability and solubility for G856-1285. Following Lipinski's Rule of Five, G856-1285 has 1 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 G856-1285?
The CAS number of G856-1285 is 536715-64-7.
What is the molecular formula of G856-1285?
The molecular formula of G856-1285 is C23H19F3N4O2S.
What is the molecular weight of G856-1285?
The molecular weight of G856-1285 is 472.12 g/mol.
Where can I buy G856-1285?
You can request a quote for G856-1285 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for G856-1285?
Yes, KEHONG BIO provides custom synthesis services for G856-1285 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.