1-Phenyl-3-(2-pyridyl)thiourea
TL;DR: 1-Phenyl-3-(2-pyridyl)thiourea (CAS 89981-44-2) is a chemical compound with molecular formula C12H11N3S and molecular weight 229.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-phenyl-3-pyridin-2-ylthiourea
Also Known As: 1-Phenyl-3-(2-pyridyl)-2-thiourea, 1-Phenyl-3-(2-pyridyl)thiourea, 1-phenyl-3-(pyridin-2-yl)thiourea, 1-phenyl-3-pyridin-2-ylthiourea, PHTU
| Molecular Formula | C12H11N3S |
|---|---|
| Molecular Weight | 229.07 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 69.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 229.06737 |
| Heavy Atoms | 16 |
| Complexity | 226.0 |
Chemical Identifiers
| CAS Number | 89981-44-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC(=S)NC2=CC=CC=N2 |
| InChIKey | JFHXWMRFXORESD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Phenyl-3-(2-pyridyl)thiourea (CAS 89981-44-2), with molecular formula C12H11N3S and molecular weight 229.07 g/mol. IUPAC: 1-phenyl-3-pyridin-2-ylthiourea.
Chemical Property Profile of 1-Phenyl-3-(2-pyridyl)thiourea
Property Insights of 1-Phenyl-3-(2-pyridyl)thiourea
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Phenyl-3-(2-pyridyl)thiourea. The TPSA of 69.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Phenyl-3-(2-pyridyl)thiourea. Following Lipinski's Rule of Five, 1-Phenyl-3-(2-pyridyl)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 1-Phenyl-3-(2-pyridyl)thiourea?
The CAS number of 1-Phenyl-3-(2-pyridyl)thiourea is 89981-44-2.
What is the molecular formula of 1-Phenyl-3-(2-pyridyl)thiourea?
The molecular formula of 1-Phenyl-3-(2-pyridyl)thiourea is C12H11N3S.
What is the molecular weight of 1-Phenyl-3-(2-pyridyl)thiourea?
The molecular weight of 1-Phenyl-3-(2-pyridyl)thiourea is 229.07 g/mol.
Where can I buy 1-Phenyl-3-(2-pyridyl)thiourea?
You can request a quote for 1-Phenyl-3-(2-pyridyl)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Phenyl-3-(2-pyridyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-Phenyl-3-(2-pyridyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.