AJ-292/13489101
TL;DR: AJ-292/13489101 (CAS 351338-62-0) is a chemical compound with molecular formula C15H20N2OS2 and molecular weight 308.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-tert-butyl-2-methylsulfanyl-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one
Also Known As: AJ-292/13489101, 7-tert-butyl-2-(methylsulfanyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one, 7-tert-butyl-2-methylsulfanyl-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one, 7-(tert-butyl)-2-(methylthio)-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4(3H)-one
| Molecular Formula | C15H20N2OS2 |
|---|---|
| Molecular Weight | 308.10 g/mol |
| LogP | 3.8575 |
| Topological Polar Surface Area | 45.75 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 308.1017 |
| Heavy Atoms | 20 |
| Complexity | 708.9574 |
Chemical Identifiers
| CAS Number | 351338-62-0 |
|---|---|
| SMILES | CC(C)(C)C1CCC2=C(C1)SC3=C2C(=O)NC(=N3)SC |
Product Overview
AJ-292/13489101 (CAS 351338-62-0), with molecular formula C15H20N2OS2 and molecular weight 308.10 g/mol. IUPAC: 7-tert-butyl-2-methylsulfanyl-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one.
Chemical Property Profile of AJ-292/13489101
Property Insights of AJ-292/13489101
The XLogP value of 3.8575 indicates that AJ-292/13489101 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.75 Ų, AJ-292/13489101 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AJ-292/13489101 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 AJ-292/13489101?
The CAS number of AJ-292/13489101 is 351338-62-0.
What is the molecular formula of AJ-292/13489101?
The molecular formula of AJ-292/13489101 is C15H20N2OS2.
What is the molecular weight of AJ-292/13489101?
The molecular weight of AJ-292/13489101 is 308.10 g/mol.
Where can I buy AJ-292/13489101?
You can request a quote for AJ-292/13489101 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AJ-292/13489101?
Yes, KEHONG BIO provides custom synthesis services for AJ-292/13489101 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.