2-iodo-N-(2-(pyridin-3-yl)piperidine-1-carbonothioyl)benzamide
TL;DR: 2-iodo-N-(2-(pyridin-3-yl)piperidine-1-carbonothioyl)benzamide (CAS 799780-44-2) is a chemical compound with molecular formula C18H18IN3OS and molecular weight 451.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-iodo-N-(2-pyridin-3-ylpiperidine-1-carbothioyl)benzamide
Also Known As: 2-iodo-N-(2-pyridin-3-ylpiperidine-1-carbothioyl)benzamide, 2-iodo-N-(2-(pyridin-3-yl)piperidine-1-carbonothioyl)benzamide
| Molecular Formula | C18H18IN3OS |
|---|---|
| Molecular Weight | 451.02 g/mol |
| LogP | 3.9281 |
| Topological Polar Surface Area | 45.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 451.0215 |
| Heavy Atoms | 24 |
| Complexity | 738.0535 |
Chemical Identifiers
| CAS Number | 799780-44-2 |
|---|---|
| SMILES | C1CCN(C(C1)C2=CN=CC=C2)C(=S)NC(=O)C3=CC=CC=C3I |
Product Overview
2-iodo-N-(2-(pyridin-3-yl)piperidine-1-carbonothioyl)benzamide (CAS 799780-44-2), with molecular formula C18H18IN3OS and molecular weight 451.02 g/mol. IUPAC: 2-iodo-N-(2-pyridin-3-ylpiperidine-1-carbothioyl)benzamide.
Chemical Property Profile of 2-iodo-N-(2-(pyridin-3-yl)piperidine-1-carbonothioyl)benzamide
Property Insights of 2-iodo-N-(2-(pyridin-3-yl)piperidine-1-carbonothioyl)benzamide
The XLogP value of 3.9281 indicates that 2-iodo-N-(2-(pyridin-3-yl)piperidine-1-carbonothioyl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.23 Ų, 2-iodo-N-(2-(pyridin-3-yl)piperidine-1-carbonothioyl)benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-iodo-N-(2-(pyridin-3-yl)piperidine-1-carbonothioyl)benzamide 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-iodo-N-(2-(pyridin-3-yl)piperidine-1-carbonothioyl)benzamide?
The CAS number of 2-iodo-N-(2-(pyridin-3-yl)piperidine-1-carbonothioyl)benzamide is 799780-44-2.
What is the molecular formula of 2-iodo-N-(2-(pyridin-3-yl)piperidine-1-carbonothioyl)benzamide?
The molecular formula of 2-iodo-N-(2-(pyridin-3-yl)piperidine-1-carbonothioyl)benzamide is C18H18IN3OS.
What is the molecular weight of 2-iodo-N-(2-(pyridin-3-yl)piperidine-1-carbonothioyl)benzamide?
The molecular weight of 2-iodo-N-(2-(pyridin-3-yl)piperidine-1-carbonothioyl)benzamide is 451.02 g/mol.
Where can I buy 2-iodo-N-(2-(pyridin-3-yl)piperidine-1-carbonothioyl)benzamide?
You can request a quote for 2-iodo-N-(2-(pyridin-3-yl)piperidine-1-carbonothioyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-iodo-N-(2-(pyridin-3-yl)piperidine-1-carbonothioyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 2-iodo-N-(2-(pyridin-3-yl)piperidine-1-carbonothioyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.