AJ-292/40706647
TL;DR: AJ-292/40706647 (CAS 375359-77-6) is a chemical compound with molecular formula C18H16N4OS and molecular weight 336.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
13-methyl-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-292/40706647, 8-methyl-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-4-phenyl-6,7,8,9-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
| Molecular Formula | C18H16N4OS |
|---|---|
| Molecular Weight | 336.10 g/mol |
| LogP | 3.2197 |
| Topological Polar Surface Area | 52.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 336.1045 |
| Heavy Atoms | 24 |
| Complexity | 1122.7919 |
Chemical Identifiers
| CAS Number | 375359-77-6 |
|---|---|
| SMILES | CC1CCC2=C(C1)SC3=C2C(=O)N(C4=NN=CN34)C5=CC=CC=C5 |
Product Overview
AJ-292/40706647 (CAS 375359-77-6), with molecular formula C18H16N4OS and molecular weight 336.10 g/mol. IUPAC: 13-methyl-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-292/40706647
Property Insights of AJ-292/40706647
The XLogP value of 3.2197 indicates that AJ-292/40706647 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.19 Ų, AJ-292/40706647 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AJ-292/40706647 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-292/40706647?
The CAS number of AJ-292/40706647 is 375359-77-6.
What is the molecular formula of AJ-292/40706647?
The molecular formula of AJ-292/40706647 is C18H16N4OS.
What is the molecular weight of AJ-292/40706647?
The molecular weight of AJ-292/40706647 is 336.10 g/mol.
Where can I buy AJ-292/40706647?
You can request a quote for AJ-292/40706647 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AJ-292/40706647?
Yes, KEHONG BIO provides custom synthesis services for AJ-292/40706647 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.