AJ-292/12415040
TL;DR: AJ-292/12415040 (CAS 352657-36-4) is a chemical compound with molecular formula C19H24N2O4S2 and molecular weight 408.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[12,12-dimethyl-4-(2-methylprop-2-enyl)-3-oxo-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-5-yl]sulfanyl]acetate
Also Known As: AJ-292/12415040, ethyl {[6,6-dimethyl-3-(2-methyl-2-propenyl)-4-oxo-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetate, ethyl {[6,6-dimethyl-3-(2-methylprop-2-en-1-yl)-4-oxo-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetate, ethyl 2-((6,6-dimethyl-3-(2-methylallyl)-4-oxo-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)acetate
| Molecular Formula | C19H24N2O4S2 |
|---|---|
| Molecular Weight | 408.12 g/mol |
| LogP | 3.5406 |
| Topological Polar Surface Area | 70.42 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 408.11774 |
| Heavy Atoms | 27 |
| Complexity | 958.75085 |
Chemical Identifiers
| CAS Number | 352657-36-4 |
|---|---|
| SMILES | CCOC(=O)CSC1=NC2=C(C3=C(S2)COC(C3)(C)C)C(=O)N1CC(=C)C |
Product Overview
AJ-292/12415040 (CAS 352657-36-4), with molecular formula C19H24N2O4S2 and molecular weight 408.12 g/mol. IUPAC: ethyl 2-[[12,12-dimethyl-4-(2-methylprop-2-enyl)-3-oxo-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-5-yl]sulfanyl]acetate.
Chemical Property Profile of AJ-292/12415040
Property Insights of AJ-292/12415040
The XLogP value of 3.5406 indicates that AJ-292/12415040 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.42 Ų falls within the moderate polarity range, balancing permeability and solubility for AJ-292/12415040. Following Lipinski's Rule of Five, AJ-292/12415040 has 0 hydrogen bond donor(s) and 7 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-292/12415040?
The CAS number of AJ-292/12415040 is 352657-36-4.
What is the molecular formula of AJ-292/12415040?
The molecular formula of AJ-292/12415040 is C19H24N2O4S2.
What is the molecular weight of AJ-292/12415040?
The molecular weight of AJ-292/12415040 is 408.12 g/mol.
Where can I buy AJ-292/12415040?
You can request a quote for AJ-292/12415040 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AJ-292/12415040?
Yes, KEHONG BIO provides custom synthesis services for AJ-292/12415040 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.