AJ-292/40675196
TL;DR: AJ-292/40675196 (CAS 375357-07-6) is a chemical compound with molecular formula C16H20N4OS2 and molecular weight 348.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
13-tert-butyl-7-methyl-3-sulfanylidene-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),5,10(15)-trien-8-one
Also Known As: AJ-292/40675196, 8-(tert-butyl)-1-mercapto-4-methyl-6,7,8,9-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one, 8-tert-butyl-4-methyl-1-sulfanyl-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one, 8-tert-butyl-4-methyl-1-thioxo-2,4,6,7,8,9-hexahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(1H)-one
| Molecular Formula | C16H20N4OS2 |
|---|---|
| Molecular Weight | 348.11 g/mol |
| LogP | 3.45629 |
| Topological Polar Surface Area | 55.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 348.10785 |
| Heavy Atoms | 23 |
| Complexity | 1044.5538 |
Chemical Identifiers
| CAS Number | 375357-07-6 |
|---|---|
| SMILES | CC(C)(C)C1CCC2=C(C1)SC3=C2C(=O)N(C4=NNC(=S)N34)C |
Product Overview
AJ-292/40675196 (CAS 375357-07-6), with molecular formula C16H20N4OS2 and molecular weight 348.11 g/mol. IUPAC: 13-tert-butyl-7-methyl-3-sulfanylidene-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),5,10(15)-trien-8-one.
Chemical Property Profile of AJ-292/40675196
Property Insights of AJ-292/40675196
The XLogP value of 3.45629 indicates that AJ-292/40675196 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.09 Ų, AJ-292/40675196 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AJ-292/40675196 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-292/40675196?
The CAS number of AJ-292/40675196 is 375357-07-6.
What is the molecular formula of AJ-292/40675196?
The molecular formula of AJ-292/40675196 is C16H20N4OS2.
What is the molecular weight of AJ-292/40675196?
The molecular weight of AJ-292/40675196 is 348.11 g/mol.
Where can I buy AJ-292/40675196?
You can request a quote for AJ-292/40675196 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AJ-292/40675196?
Yes, KEHONG BIO provides custom synthesis services for AJ-292/40675196 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.