2-Pyridinecarbothioamide, 4-(hexadecylthio)-
TL;DR: 2-Pyridinecarbothioamide, 4-(hexadecylthio)- (CAS 186044-69-9) is a chemical compound with molecular formula C22H38N2S2 and molecular weight 394.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-hexadecylsulfanylpyridine-2-carbothioamide
Also Known As: 2-Pyridinecarbothioamide, 4-(hexadecylthio)-, 4-hexadecylsulfanylpyridine-2-carbothioamide, 4-Alkylthiopyridine-2-carbothioamide der., 4-(Hexadecylthio)pyridine-2-carbothioamide, 4-(HEXADECYLSULFANYL)PYRIDINE-2-CARBOTHIOAMIDE
| Molecular Formula | C22H38N2S2 |
|---|---|
| Molecular Weight | 394.25 g/mol |
| LogP | 7.2892 |
| Topological Polar Surface Area | 38.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 17 |
| Exact Mass | 394.24765 |
| Heavy Atoms | 26 |
| Complexity | 476.965 |
Chemical Identifiers
| CAS Number | 186044-69-9 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCSC1=CC(=NC=C1)C(=S)N |
Product Overview
2-Pyridinecarbothioamide, 4-(hexadecylthio)- (CAS 186044-69-9), with molecular formula C22H38N2S2 and molecular weight 394.25 g/mol. IUPAC: 4-hexadecylsulfanylpyridine-2-carbothioamide.
Chemical Property Profile of 2-Pyridinecarbothioamide, 4-(hexadecylthio)-
Property Insights of 2-Pyridinecarbothioamide, 4-(hexadecylthio)-
The XLogP value of 7.2892 indicates that 2-Pyridinecarbothioamide, 4-(hexadecylthio)- 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-(hexadecylthio)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Pyridinecarbothioamide, 4-(hexadecylthio)- has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Pyridinecarbothioamide, 4-(hexadecylthio)-?
The CAS number of 2-Pyridinecarbothioamide, 4-(hexadecylthio)- is 186044-69-9.
What is the molecular formula of 2-Pyridinecarbothioamide, 4-(hexadecylthio)-?
The molecular formula of 2-Pyridinecarbothioamide, 4-(hexadecylthio)- is C22H38N2S2.
What is the molecular weight of 2-Pyridinecarbothioamide, 4-(hexadecylthio)-?
The molecular weight of 2-Pyridinecarbothioamide, 4-(hexadecylthio)- is 394.25 g/mol.
Where can I buy 2-Pyridinecarbothioamide, 4-(hexadecylthio)-?
You can request a quote for 2-Pyridinecarbothioamide, 4-(hexadecylthio)- 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-(hexadecylthio)-?
Yes, KEHONG BIO provides custom synthesis services for 2-Pyridinecarbothioamide, 4-(hexadecylthio)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.