AJ-292/40706553
TL;DR: AJ-292/40706553 (CAS 375362-38-2) is a chemical compound with molecular formula C26H22N4O2S2 and molecular weight 486.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
13-methyl-3-phenacylsulfanyl-7-phenyl-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-8-one
Also Known As: AJ-292/40706553, 8-methyl-1-[(2-oxo-2-phenylethyl)sulfanyl]-4-phenyl-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one, 8-methyl-1-((2-oxo-2-phenylethyl)thio)-4-phenyl-6,7,8,9-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one, 13-methyl-3-phenacylsulfanyl-7-phenyl-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-8-one
| Molecular Formula | C26H22N4O2S2 |
|---|---|
| Molecular Weight | 486.12 g/mol |
| LogP | 5.1947 |
| Topological Polar Surface Area | 69.26 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 486.1184 |
| Heavy Atoms | 34 |
| Complexity | 1585.9701 |
Chemical Identifiers
| CAS Number | 375362-38-2 |
|---|---|
| SMILES | CC1CCC2=C(C1)SC3=C2C(=O)N(C4=NN=C(N34)SCC(=O)C5=CC=CC=C5)C6=CC=CC=C6 |
Product Overview
AJ-292/40706553 (CAS 375362-38-2), with molecular formula C26H22N4O2S2 and molecular weight 486.12 g/mol. IUPAC: 13-methyl-3-phenacylsulfanyl-7-phenyl-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-8-one.
Chemical Property Profile of AJ-292/40706553
Property Insights of AJ-292/40706553
The XLogP value of 5.1947 indicates that AJ-292/40706553 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.26 Ų falls within the moderate polarity range, balancing permeability and solubility for AJ-292/40706553. Following Lipinski's Rule of Five, AJ-292/40706553 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AJ-292/40706553?
The CAS number of AJ-292/40706553 is 375362-38-2.
What is the molecular formula of AJ-292/40706553?
The molecular formula of AJ-292/40706553 is C26H22N4O2S2.
What is the molecular weight of AJ-292/40706553?
The molecular weight of AJ-292/40706553 is 486.12 g/mol.
Where can I buy AJ-292/40706553?
You can request a quote for AJ-292/40706553 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AJ-292/40706553?
Yes, KEHONG BIO provides custom synthesis services for AJ-292/40706553 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.