4-Pyridineethanethioamide
TL;DR: 4-Pyridineethanethioamide (CAS 5451-38-7) is a chemical compound with molecular formula C7H8N2S and molecular weight 152.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-pyridin-4-ylethanethioamide
Also Known As: 4-Pyridineethanethioamide, 2-(PYRIDIN-4-YL)ETHANETHIOAMIDE, Thio-4-pyridineacetamide, 4-Pyridineacetamide, thio-, 2-pyridin-4-ylethanethioamide
| Molecular Formula | C7H8N2S |
|---|---|
| Molecular Weight | 152.04 g/mol |
| LogP | 0.9102 |
| Topological Polar Surface Area | 38.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 152.04082 |
| Heavy Atoms | 10 |
| Complexity | 220.30753 |
Chemical Identifiers
| CAS Number | 5451-38-7 |
|---|---|
| SMILES | C1=CN=CC=C1CC(=S)N |
Product Overview
4-Pyridineethanethioamide (CAS 5451-38-7), with molecular formula C7H8N2S and molecular weight 152.04 g/mol. IUPAC: 2-pyridin-4-ylethanethioamide.
Chemical Property Profile of 4-Pyridineethanethioamide
Property Insights of 4-Pyridineethanethioamide
The XLogP value of 0.9102 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Pyridineethanethioamide. With a topological polar surface area (TPSA) of 38.91 Ų, 4-Pyridineethanethioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Pyridineethanethioamide has 1 hydrogen bond donor(s) and 2 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 4-Pyridineethanethioamide?
The CAS number of 4-Pyridineethanethioamide is 5451-38-7.
What is the molecular formula of 4-Pyridineethanethioamide?
The molecular formula of 4-Pyridineethanethioamide is C7H8N2S.
What is the molecular weight of 4-Pyridineethanethioamide?
The molecular weight of 4-Pyridineethanethioamide is 152.04 g/mol.
Where can I buy 4-Pyridineethanethioamide?
You can request a quote for 4-Pyridineethanethioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Pyridineethanethioamide?
Yes, KEHONG BIO provides custom synthesis services for 4-Pyridineethanethioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.