N-(Piperidine-1-carbothioyl)-nicotinamide
TL;DR: N-(Piperidine-1-carbothioyl)-nicotinamide (CAS 307331-15-3) is a chemical compound with molecular formula C12H15N3OS and molecular weight 249.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(piperidine-1-carbothioyl)pyridine-3-carboxamide
Also Known As: BAS 00227235, N-(Piperidine-1-carbothioyl)-nicotinamide, N-(piperidine-1-carbonothioyl)nicotinamide, N-(piperidine-1-carbothioyl)pyridine-3-carboxamide, N-(piperidin-1-ylcarbonothioyl)pyridine-3-carboxamide
| Molecular Formula | C12H15N3OS |
|---|---|
| Molecular Weight | 249.09 g/mol |
| LogP | 1.5822 |
| Topological Polar Surface Area | 45.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 249.09358 |
| Heavy Atoms | 17 |
| Complexity | 401.4716 |
Chemical Identifiers
| CAS Number | 307331-15-3 |
|---|---|
| SMILES | C1CCN(CC1)C(=S)NC(=O)C2=CN=CC=C2 |
Product Overview
N-(Piperidine-1-carbothioyl)-nicotinamide (CAS 307331-15-3), with molecular formula C12H15N3OS and molecular weight 249.09 g/mol. IUPAC: N-(piperidine-1-carbothioyl)pyridine-3-carboxamide.
Chemical Property Profile of N-(Piperidine-1-carbothioyl)-nicotinamide
Property Insights of N-(Piperidine-1-carbothioyl)-nicotinamide
The XLogP value of 1.5822 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(Piperidine-1-carbothioyl)-nicotinamide. With a topological polar surface area (TPSA) of 45.23 Ų, N-(Piperidine-1-carbothioyl)-nicotinamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(Piperidine-1-carbothioyl)-nicotinamide 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 N-(Piperidine-1-carbothioyl)-nicotinamide?
The CAS number of N-(Piperidine-1-carbothioyl)-nicotinamide is 307331-15-3.
What is the molecular formula of N-(Piperidine-1-carbothioyl)-nicotinamide?
The molecular formula of N-(Piperidine-1-carbothioyl)-nicotinamide is C12H15N3OS.
What is the molecular weight of N-(Piperidine-1-carbothioyl)-nicotinamide?
The molecular weight of N-(Piperidine-1-carbothioyl)-nicotinamide is 249.09 g/mol.
Where can I buy N-(Piperidine-1-carbothioyl)-nicotinamide?
You can request a quote for N-(Piperidine-1-carbothioyl)-nicotinamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(Piperidine-1-carbothioyl)-nicotinamide?
Yes, KEHONG BIO provides custom synthesis services for N-(Piperidine-1-carbothioyl)-nicotinamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.