AJ-292/40884731
TL;DR: AJ-292/40884731 (CAS 374547-86-1) is a chemical compound with molecular formula C18H18N2OS2 and molecular weight 342.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
10-methylsulfanyl-11-(2-phenylethyl)-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-12-one
Also Known As: AJ-292/40884731, 2-(methylsulfanyl)-3-(2-phenylethyl)-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one, 2-(methylthio)-3-phenethyl-6,7-dihydro-3H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4(5H)-one
| Molecular Formula | C18H18N2OS2 |
|---|---|
| Molecular Weight | 342.09 g/mol |
| LogP | 3.9113 |
| Topological Polar Surface Area | 34.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 342.08606 |
| Heavy Atoms | 23 |
| Complexity | 912.15656 |
Chemical Identifiers
| CAS Number | 374547-86-1 |
|---|---|
| SMILES | CSC1=NC2=C(C3=C(S2)CCC3)C(=O)N1CCC4=CC=CC=C4 |
Product Overview
AJ-292/40884731 (CAS 374547-86-1), with molecular formula C18H18N2OS2 and molecular weight 342.09 g/mol. IUPAC: 10-methylsulfanyl-11-(2-phenylethyl)-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-12-one.
Chemical Property Profile of AJ-292/40884731
Property Insights of AJ-292/40884731
The XLogP value of 3.9113 indicates that AJ-292/40884731 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.89 Ų, AJ-292/40884731 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AJ-292/40884731 has 0 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 AJ-292/40884731?
The CAS number of AJ-292/40884731 is 374547-86-1.
What is the molecular formula of AJ-292/40884731?
The molecular formula of AJ-292/40884731 is C18H18N2OS2.
What is the molecular weight of AJ-292/40884731?
The molecular weight of AJ-292/40884731 is 342.09 g/mol.
Where can I buy AJ-292/40884731?
You can request a quote for AJ-292/40884731 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AJ-292/40884731?
Yes, KEHONG BIO provides custom synthesis services for AJ-292/40884731 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.