![N-hexyldithiolo[3,4-b]pyridin-3-imine structure](/static/products/154/154344-38-4.webp)
N-hexyldithiolo[3,4-b]pyridin-3-imine
TL;DR: N-hexyldithiolo[3,4-b]pyridin-3-imine (CAS 154344-38-4) is a chemical compound with molecular formula C12H16N2S2 and molecular weight 252.07549 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-hexyldithiolo[3,4-b]pyridin-3-imine
Also Known As: N-hexyldithiolo[3,4-b]pyridin-3-imine, J1.273.114K, 3-(Hexylimino)-3H-1,2-dithiolo[3,4-b]pyridine, N-Hexyl-3-imino-3H-1,2-dithiolo[3,4-b]pyridine, N-Hexyl-3H-1,2-dithiolo[3,4-b]pyridine-3-imine
Technical Specifications
| Molecular Formula | C12H16N2S2 |
| Molecular Weight | 252.07549 g/mol |
| XLogP | 3.7 |
| Topological Polar Surface Area (TPSA) | 75.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 252.07549 Da |
| Heavy Atoms | 16 |
| Complexity | 243.0 |
| SMILES | CCCCCCN=C1C2=C(N=CC=C2)SS1 |
| InChIKey | VVXIAJWTIFDRKA-UHFFFAOYSA-N |
Chemical Property Profile of N-hexyldithiolo[3,4-b]pyridin-3-imine
Property Insights of N-hexyldithiolo[3,4-b]pyridin-3-imine
The XLogP value of 3.7 indicates that N-hexyldithiolo[3,4-b]pyridin-3-imine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.9 Ų falls within the moderate polarity range, balancing permeability and solubility for N-hexyldithiolo[3,4-b]pyridin-3-imine. Following Lipinski's Rule of Five, N-hexyldithiolo[3,4-b]pyridin-3-imine 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
What is the CAS number of N-hexyldithiolo[3,4-b]pyridin-3-imine?
The CAS number of N-hexyldithiolo[3,4-b]pyridin-3-imine is 154344-38-4.
What is the molecular formula of N-hexyldithiolo[3,4-b]pyridin-3-imine?
The molecular formula of N-hexyldithiolo[3,4-b]pyridin-3-imine is C12H16N2S2.
What is the molecular weight of N-hexyldithiolo[3,4-b]pyridin-3-imine?
The molecular weight of N-hexyldithiolo[3,4-b]pyridin-3-imine is 252.07549 g/mol.
Where can I buy N-hexyldithiolo[3,4-b]pyridin-3-imine?
You can request a quote for N-hexyldithiolo[3,4-b]pyridin-3-imine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-hexyldithiolo[3,4-b]pyridin-3-imine?
Yes, CoreyChem provides custom synthesis services for N-hexyldithiolo[3,4-b]pyridin-3-imine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.