4-Methyl-N-phenyl-2-pyridinecarbothioamide
TL;DR: 4-Methyl-N-phenyl-2-pyridinecarbothioamide (CAS 4593-06-0) is a chemical compound with molecular formula C13H12N2S and molecular weight 228.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-N-phenylpyridine-2-carbothioamide
Also Known As: 4-Methyl-N-phenyl-2-pyridinecarbothioamide, 4-methyl-N-phenylpyridine-2-carbothioamide
| Molecular Formula | C13H12N2S |
|---|---|
| Molecular Weight | 228.07 g/mol |
| LogP | 3.17762 |
| Topological Polar Surface Area | 24.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 228.07211 |
| Heavy Atoms | 16 |
| Complexity | 494.2956 |
Chemical Identifiers
| CAS Number | 4593-06-0 |
|---|---|
| SMILES | CC1=CC(=NC=C1)C(=S)NC2=CC=CC=C2 |
Product Overview
4-Methyl-N-phenyl-2-pyridinecarbothioamide (CAS 4593-06-0), with molecular formula C13H12N2S and molecular weight 228.07 g/mol. IUPAC: 4-methyl-N-phenylpyridine-2-carbothioamide.
Chemical Property Profile of 4-Methyl-N-phenyl-2-pyridinecarbothioamide
Property Insights of 4-Methyl-N-phenyl-2-pyridinecarbothioamide
The XLogP value of 3.17762 indicates that 4-Methyl-N-phenyl-2-pyridinecarbothioamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 24.92 Ų, 4-Methyl-N-phenyl-2-pyridinecarbothioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Methyl-N-phenyl-2-pyridinecarbothioamide 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-Methyl-N-phenyl-2-pyridinecarbothioamide?
The CAS number of 4-Methyl-N-phenyl-2-pyridinecarbothioamide is 4593-06-0.
What is the molecular formula of 4-Methyl-N-phenyl-2-pyridinecarbothioamide?
The molecular formula of 4-Methyl-N-phenyl-2-pyridinecarbothioamide is C13H12N2S.
What is the molecular weight of 4-Methyl-N-phenyl-2-pyridinecarbothioamide?
The molecular weight of 4-Methyl-N-phenyl-2-pyridinecarbothioamide is 228.07 g/mol.
Where can I buy 4-Methyl-N-phenyl-2-pyridinecarbothioamide?
You can request a quote for 4-Methyl-N-phenyl-2-pyridinecarbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methyl-N-phenyl-2-pyridinecarbothioamide?
Yes, KEHONG BIO provides custom synthesis services for 4-Methyl-N-phenyl-2-pyridinecarbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.