1-(4-Fluorophenyl)-3-pyridin-2-ylthiourea
TL;DR: 1-(4-Fluorophenyl)-3-pyridin-2-ylthiourea (CAS 331-00-0) is a chemical compound with molecular formula C12H10FN3S and molecular weight 247.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-fluorophenyl)-3-pyridin-2-ylthiourea
Also Known As: 1-(4-fluorophenyl)-3-pyridin-2-ylthiourea, 3-(4-fluorophenyl)-1-pyridin-2-yl-thiourea, N-p-fluorophenyl-N'-2-pyridylthiourea, N-(4-fluorophenyl)-N'-2-pyridinylthiourea, BIM-0047234.P001
| Molecular Formula | C12H10FN3S |
|---|---|
| Molecular Weight | 247.06 g/mol |
| LogP | 3.0296 |
| Topological Polar Surface Area | 36.95 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 247.05795 |
| Heavy Atoms | 17 |
| Complexity | 498.919 |
Chemical Identifiers
| CAS Number | 331-00-0 |
|---|---|
| SMILES | C1=CC=NC(=C1)NC(=S)NC2=CC=C(C=C2)F |
Product Overview
1-(4-Fluorophenyl)-3-pyridin-2-ylthiourea (CAS 331-00-0), with molecular formula C12H10FN3S and molecular weight 247.06 g/mol. IUPAC: 1-(4-fluorophenyl)-3-pyridin-2-ylthiourea.
Chemical Property Profile of 1-(4-Fluorophenyl)-3-pyridin-2-ylthiourea
Property Insights of 1-(4-Fluorophenyl)-3-pyridin-2-ylthiourea
The XLogP value of 3.0296 indicates that 1-(4-Fluorophenyl)-3-pyridin-2-ylthiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 36.95 Ų, 1-(4-Fluorophenyl)-3-pyridin-2-ylthiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Fluorophenyl)-3-pyridin-2-ylthiourea 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-(4-Fluorophenyl)-3-pyridin-2-ylthiourea?
The CAS number of 1-(4-Fluorophenyl)-3-pyridin-2-ylthiourea is 331-00-0.
What is the molecular formula of 1-(4-Fluorophenyl)-3-pyridin-2-ylthiourea?
The molecular formula of 1-(4-Fluorophenyl)-3-pyridin-2-ylthiourea is C12H10FN3S.
What is the molecular weight of 1-(4-Fluorophenyl)-3-pyridin-2-ylthiourea?
The molecular weight of 1-(4-Fluorophenyl)-3-pyridin-2-ylthiourea is 247.06 g/mol.
Where can I buy 1-(4-Fluorophenyl)-3-pyridin-2-ylthiourea?
You can request a quote for 1-(4-Fluorophenyl)-3-pyridin-2-ylthiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Fluorophenyl)-3-pyridin-2-ylthiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Fluorophenyl)-3-pyridin-2-ylthiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.