1-(4-Fluorophenyl)-3-(2-piperidin-1-ylethyl)thiourea
TL;DR: 1-(4-Fluorophenyl)-3-(2-piperidin-1-ylethyl)thiourea (CAS 897504-29-9) is a chemical compound with molecular formula C14H20FN3S and molecular weight 281.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-fluorophenyl)-3-(2-piperidin-1-ylethyl)thiourea
Also Known As: 1-(4-fluorophenyl)-3-(2-piperidin-1-ylethyl)thiourea, 3-(4-fluorophenyl)-1-[2-(1-piperidyl)ethyl]thiourea, 1-(4-fluorophenyl)-3-[2-(piperidin-1-yl)ethyl]thiourea, [(4-fluorophenyl)amino][(2-piperidylethyl)amino]methane-1-thione
| Molecular Formula | C14H20FN3S |
|---|---|
| Molecular Weight | 281.14 g/mol |
| LogP | 2.598 |
| Topological Polar Surface Area | 27.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 281.1362 |
| Heavy Atoms | 19 |
| Complexity | 401.65704 |
Chemical Identifiers
| CAS Number | 897504-29-9 |
|---|---|
| SMILES | C1CCN(CC1)CCNC(=S)NC2=CC=C(C=C2)F |
Product Overview
1-(4-Fluorophenyl)-3-(2-piperidin-1-ylethyl)thiourea (CAS 897504-29-9), with molecular formula C14H20FN3S and molecular weight 281.14 g/mol. IUPAC: 1-(4-fluorophenyl)-3-(2-piperidin-1-ylethyl)thiourea.
Chemical Property Profile of 1-(4-Fluorophenyl)-3-(2-piperidin-1-ylethyl)thiourea
Property Insights of 1-(4-Fluorophenyl)-3-(2-piperidin-1-ylethyl)thiourea
The XLogP value of 2.598 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Fluorophenyl)-3-(2-piperidin-1-ylethyl)thiourea. With a topological polar surface area (TPSA) of 27.3 Ų, 1-(4-Fluorophenyl)-3-(2-piperidin-1-ylethyl)thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Fluorophenyl)-3-(2-piperidin-1-ylethyl)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-(4-Fluorophenyl)-3-(2-piperidin-1-ylethyl)thiourea?
The CAS number of 1-(4-Fluorophenyl)-3-(2-piperidin-1-ylethyl)thiourea is 897504-29-9.
What is the molecular formula of 1-(4-Fluorophenyl)-3-(2-piperidin-1-ylethyl)thiourea?
The molecular formula of 1-(4-Fluorophenyl)-3-(2-piperidin-1-ylethyl)thiourea is C14H20FN3S.
What is the molecular weight of 1-(4-Fluorophenyl)-3-(2-piperidin-1-ylethyl)thiourea?
The molecular weight of 1-(4-Fluorophenyl)-3-(2-piperidin-1-ylethyl)thiourea is 281.14 g/mol.
Where can I buy 1-(4-Fluorophenyl)-3-(2-piperidin-1-ylethyl)thiourea?
You can request a quote for 1-(4-Fluorophenyl)-3-(2-piperidin-1-ylethyl)thiourea 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-(2-piperidin-1-ylethyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Fluorophenyl)-3-(2-piperidin-1-ylethyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.