J1.044.157I
TL;DR: J1.044.157I (CAS 138292-14-5) is a chemical compound with molecular formula C12H14N2OS and molecular weight 234.08269 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3,3,8-trimethyl-6-oxo-4,7-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile
Also Known As: J1.044.157I, 3,3,8-Trimethyl-6-oxo-3,4,6,7-tetrahydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile, 3,3,8-trimethyl-6-oxo-7-hydro-1H,4H-thiano[5,4-c]pyridine-5-carbonitrile, 3,3,8-trimethyl-6-oxo-1H,3H,4H,6H,7H-thiopyrano[3,4-c]pyridine-5-carbonitrile, 3,3,8-trimethyl-6-oxo-4,7-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile
Technical Specifications
| Molecular Formula | C12H14N2OS |
| Molecular Weight | 234.08269 g/mol |
| XLogP | 0.7 |
| Topological Polar Surface Area (TPSA) | 78.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 234.08269 Da |
| Heavy Atoms | 16 |
| Complexity | 476.0 |
| SMILES | CC1=C2CSC(CC2=C(C(=O)N1)C#N)(C)C |
| InChIKey | ATTBSDWTWVOOIF-UHFFFAOYSA-N |
Chemical Property Profile of J1.044.157I
Property Insights of J1.044.157I
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for J1.044.157I. The TPSA of 78.2 Ų falls within the moderate polarity range, balancing permeability and solubility for J1.044.157I. Following Lipinski's Rule of Five, J1.044.157I has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of J1.044.157I?
The CAS number of J1.044.157I is 138292-14-5.
What is the molecular formula of J1.044.157I?
The molecular formula of J1.044.157I is C12H14N2OS.
What is the molecular weight of J1.044.157I?
The molecular weight of J1.044.157I is 234.08269 g/mol.
Where can I buy J1.044.157I?
You can request a quote for J1.044.157I directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for J1.044.157I?
Yes, CoreyChem provides custom synthesis services for J1.044.157I and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.