(5-Chloropyridin-2-YL)thiourea
TL;DR: (5-Chloropyridin-2-YL)thiourea (CAS 31430-27-0) is a chemical compound with molecular formula C6H6ClN3S and molecular weight 187.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5-chloro-2-pyridinyl)thiourea
Also Known As: (5-chloropyridin-2-yl)thiourea, 1-(5-chloropyridin-2-yl)thiourea, (5-Chloro-pyridin-2-yl)-thiourea, (5-Chloro-2-pyridyl)thiourea, 5-chloropyridin-2-ylthiourea
| Molecular Formula | C6H6ClN3S |
|---|---|
| Molecular Weight | 187.00 g/mol |
| LogP | 1.3905 |
| Topological Polar Surface Area | 50.94 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 186.9971 |
| Heavy Atoms | 11 |
| Complexity | 259.03482 |
Chemical Identifiers
| CAS Number | 31430-27-0 |
|---|---|
| SMILES | C1=CC(=NC=C1Cl)NC(=S)N |
Product Overview
(5-Chloropyridin-2-YL)thiourea (CAS 31430-27-0), with molecular formula C6H6ClN3S and molecular weight 187.00 g/mol. IUPAC: (5-chloro-2-pyridinyl)thiourea.
Chemical Property Profile of (5-Chloropyridin-2-YL)thiourea
Property Insights of (5-Chloropyridin-2-YL)thiourea
The XLogP value of 1.3905 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (5-Chloropyridin-2-YL)thiourea. With a topological polar surface area (TPSA) of 50.94 Ų, (5-Chloropyridin-2-YL)thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (5-Chloropyridin-2-YL)thiourea has 2 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 (5-Chloropyridin-2-YL)thiourea?
The CAS number of (5-Chloropyridin-2-YL)thiourea is 31430-27-0.
What is the molecular formula of (5-Chloropyridin-2-YL)thiourea?
The molecular formula of (5-Chloropyridin-2-YL)thiourea is C6H6ClN3S.
What is the molecular weight of (5-Chloropyridin-2-YL)thiourea?
The molecular weight of (5-Chloropyridin-2-YL)thiourea is 187.00 g/mol.
Where can I buy (5-Chloropyridin-2-YL)thiourea?
You can request a quote for (5-Chloropyridin-2-YL)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (5-Chloropyridin-2-YL)thiourea?
Yes, KEHONG BIO provides custom synthesis services for (5-Chloropyridin-2-YL)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.