AJ-292/14559247
TL;DR: AJ-292/14559247 (CAS 430472-14-3) is a chemical compound with molecular formula C17H22N2O3S2 and molecular weight 366.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[(11-butyl-12-oxo-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl)sulfanyl]acetate
Also Known As: AJ-292/14559247, ethyl [(3-butyl-4-oxo-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetate, ethyl 2-((3-butyl-4-oxo-4,5,6,7-tetrahydro-3H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl)thio)acetate, ETHYL 2-({11-BUTYL-12-OXO-7-THIA-9,11-DIAZATRICYCLO[6.4.0.0(2),?]DODECA-1(8),2(6),9-TRIEN-10-YL}SULFANYL)ACETATE, ethyl 2-(3-butyl-4-oxo-3,5,6,7-tetrahydrocyclopenta[2,1-d]pyrimidino[4,5-b]thi ophen-2-ylthio)acetate
| Molecular Formula | C17H22N2O3S2 |
|---|---|
| Molecular Weight | 366.11 g/mol |
| LogP | 3.402 |
| Topological Polar Surface Area | 61.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 366.10718 |
| Heavy Atoms | 24 |
| Complexity | 810.249 |
Chemical Identifiers
| CAS Number | 430472-14-3 |
|---|---|
| SMILES | CCCCN1C(=O)C2=C(N=C1SCC(=O)OCC)SC3=C2CCC3 |
Product Overview
AJ-292/14559247 (CAS 430472-14-3), with molecular formula C17H22N2O3S2 and molecular weight 366.11 g/mol. IUPAC: ethyl 2-[(11-butyl-12-oxo-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl)sulfanyl]acetate.
Chemical Property Profile of AJ-292/14559247
Property Insights of AJ-292/14559247
The XLogP value of 3.402 indicates that AJ-292/14559247 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.19 Ų falls within the moderate polarity range, balancing permeability and solubility for AJ-292/14559247. Following Lipinski's Rule of Five, AJ-292/14559247 has 0 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-292/14559247?
The CAS number of AJ-292/14559247 is 430472-14-3.
What is the molecular formula of AJ-292/14559247?
The molecular formula of AJ-292/14559247 is C17H22N2O3S2.
What is the molecular weight of AJ-292/14559247?
The molecular weight of AJ-292/14559247 is 366.11 g/mol.
Where can I buy AJ-292/14559247?
You can request a quote for AJ-292/14559247 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AJ-292/14559247?
Yes, KEHONG BIO provides custom synthesis services for AJ-292/14559247 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.