2-Pyridinecarbothioamide, 4-(hexylthio)-
TL;DR: 2-Pyridinecarbothioamide, 4-(hexylthio)- (CAS 186044-64-4) is a chemical compound with molecular formula C12H18N2S2 and molecular weight 254.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-hexylsulfanylpyridine-2-carbothioamide
Also Known As: 2-Pyridinecarbothioamide, 4-(hexylthio)-, 4-hexylsulfanylpyridine-2-carbothioamide, 4-(hexylsulfanyl)pyridine-2-carbothioamide, 4-(Hexylthio)pyridine-2-carbothioamide, 4-Alkylthiopyridine-2-carbothioamide der.
| Molecular Formula | C12H18N2S2 |
|---|---|
| Molecular Weight | 254.09 g/mol |
| LogP | 3.3882 |
| Topological Polar Surface Area | 38.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 254.09114 |
| Heavy Atoms | 16 |
| Complexity | 339.54556 |
Chemical Identifiers
| CAS Number | 186044-64-4 |
|---|---|
| SMILES | CCCCCCSC1=CC(=NC=C1)C(=S)N |
Product Overview
2-Pyridinecarbothioamide, 4-(hexylthio)- (CAS 186044-64-4), with molecular formula C12H18N2S2 and molecular weight 254.09 g/mol. IUPAC: 4-hexylsulfanylpyridine-2-carbothioamide.
Chemical Property Profile of 2-Pyridinecarbothioamide, 4-(hexylthio)-
Property Insights of 2-Pyridinecarbothioamide, 4-(hexylthio)-
The XLogP value of 3.3882 indicates that 2-Pyridinecarbothioamide, 4-(hexylthio)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.91 Ų, 2-Pyridinecarbothioamide, 4-(hexylthio)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Pyridinecarbothioamide, 4-(hexylthio)- 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
Frequently Asked Questions
What is the CAS number of 2-Pyridinecarbothioamide, 4-(hexylthio)-?
The CAS number of 2-Pyridinecarbothioamide, 4-(hexylthio)- is 186044-64-4.
What is the molecular formula of 2-Pyridinecarbothioamide, 4-(hexylthio)-?
The molecular formula of 2-Pyridinecarbothioamide, 4-(hexylthio)- is C12H18N2S2.
What is the molecular weight of 2-Pyridinecarbothioamide, 4-(hexylthio)-?
The molecular weight of 2-Pyridinecarbothioamide, 4-(hexylthio)- is 254.09 g/mol.
Where can I buy 2-Pyridinecarbothioamide, 4-(hexylthio)-?
You can request a quote for 2-Pyridinecarbothioamide, 4-(hexylthio)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Pyridinecarbothioamide, 4-(hexylthio)-?
Yes, KEHONG BIO provides custom synthesis services for 2-Pyridinecarbothioamide, 4-(hexylthio)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.