AJ-292/11386006
TL;DR: AJ-292/11386006 (CAS 383395-47-9) is a chemical compound with molecular formula C19H19N5S3 and molecular weight 413.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
13-benzyl-7-ethylsulfanyl-10-thia-3,4,6,8,13-pentazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,7,11(16)-tetraene-5-thione
Also Known As: AJ-292/11386006, 9-benzyl-5-(ethylthio)-8,9,10,11-tetrahydropyrido[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine-3(2H)-thione, 9-benzyl-5-(ethylsulfanyl)-8,9,10,11-tetrahydropyrido[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine-3(2H)-thione, 9-benzyl-5-(ethylsulfanyl)-8,9,10,11-tetrahydropyrido[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine-3-thiol
| Molecular Formula | C19H19N5S3 |
|---|---|
| Molecular Weight | 413.08 g/mol |
| LogP | 4.67189 |
| Topological Polar Surface Area | 49.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 413.08026 |
| Heavy Atoms | 27 |
| Complexity | 1174.9624 |
Chemical Identifiers
| CAS Number | 383395-47-9 |
|---|---|
| SMILES | CCSC1=NC2=C(C3=C(S2)CN(CC3)CC4=CC=CC=C4)C5=NNC(=S)N51 |
Product Overview
AJ-292/11386006 (CAS 383395-47-9), with molecular formula C19H19N5S3 and molecular weight 413.08 g/mol. IUPAC: 13-benzyl-7-ethylsulfanyl-10-thia-3,4,6,8,13-pentazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,7,11(16)-tetraene-5-thione.
Chemical Property Profile of AJ-292/11386006
Property Insights of AJ-292/11386006
The XLogP value of 4.67189 indicates that AJ-292/11386006 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.22 Ų, AJ-292/11386006 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AJ-292/11386006 has 1 hydrogen bond donor(s) and 6 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-292/11386006?
The CAS number of AJ-292/11386006 is 383395-47-9.
What is the molecular formula of AJ-292/11386006?
The molecular formula of AJ-292/11386006 is C19H19N5S3.
What is the molecular weight of AJ-292/11386006?
The molecular weight of AJ-292/11386006 is 413.08 g/mol.
Where can I buy AJ-292/11386006?
You can request a quote for AJ-292/11386006 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AJ-292/11386006?
Yes, KEHONG BIO provides custom synthesis services for AJ-292/11386006 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.