AP-906/41641817
TL;DR: AP-906/41641817 (CAS 1008667-14-8) is a chemical compound with molecular formula C18H20N2O5S2 and molecular weight 408.08136 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 2-[(2-thiophen-2-ylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carbonyl)amino]acetate
Also Known As: AP-906/41641817, ethyl ({[2-(2-thienylsulfonyl)-1,2,3,4-tetrahydro-3-isoquinolinyl]carbonyl}amino)acetate, ethyl 2-[(2-thiophen-2-ylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carbonyl)amino]acetate, ethyl 2-(2-(thiophen-2-ylsulfonyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxamido)acetate, ethyl N-{[2-(2-thienylsulfonyl)-1,2,3,4-tetrahydro-3-isoquinolinyl]carbonyl}glycinate
Technical Specifications
| Molecular Formula | C18H20N2O5S2 |
| Molecular Weight | 408.08136 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 129.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 408.08136 Da |
| Heavy Atoms | 27 |
| Complexity | 649.0 |
| SMILES | CCOC(=O)CNC(=O)C1CC2=CC=CC=C2CN1S(=O)(=O)C3=CC=CS3 |
| InChIKey | XSYQUIVNJJABLP-UHFFFAOYSA-N |
Chemical Property Profile of AP-906/41641817
Property Insights of AP-906/41641817
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AP-906/41641817. The TPSA of 129.0 Ų falls within the moderate polarity range, balancing permeability and solubility for AP-906/41641817. Following Lipinski's Rule of Five, AP-906/41641817 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of AP-906/41641817?
The CAS number of AP-906/41641817 is 1008667-14-8.
What is the molecular formula of AP-906/41641817?
The molecular formula of AP-906/41641817 is C18H20N2O5S2.
What is the molecular weight of AP-906/41641817?
The molecular weight of AP-906/41641817 is 408.08136 g/mol.
Where can I buy AP-906/41641817?
You can request a quote for AP-906/41641817 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for AP-906/41641817?
Yes, CoreyChem provides custom synthesis services for AP-906/41641817 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.