1-Benzyl-3-(4-fluorophenyl)-1-(2-hydroxyethyl)thiourea
TL;DR: 1-Benzyl-3-(4-fluorophenyl)-1-(2-hydroxyethyl)thiourea (CAS 436109-99-8) is a chemical compound with molecular formula C16H17FN2OS and molecular weight 304.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzyl-3-(4-fluorophenyl)-1-(2-hydroxyethyl)thiourea
Also Known As: 1-benzyl-3-(4-fluorophenyl)-1-(2-hydroxyethyl)thiourea, N-Benzyl-N'-(4-fluorophenyl)-N-(2-hydroxyethyl)thiourea
| Molecular Formula | C16H17FN2OS |
|---|---|
| Molecular Weight | 304.10 g/mol |
| LogP | 3.017 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 304.10455 |
| Heavy Atoms | 21 |
| Complexity | 574.59064 |
Chemical Identifiers
| CAS Number | 436109-99-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN(CCO)C(=S)NC2=CC=C(C=C2)F |
Product Overview
1-Benzyl-3-(4-fluorophenyl)-1-(2-hydroxyethyl)thiourea (CAS 436109-99-8), with molecular formula C16H17FN2OS and molecular weight 304.10 g/mol. IUPAC: 1-benzyl-3-(4-fluorophenyl)-1-(2-hydroxyethyl)thiourea.
Chemical Property Profile of 1-Benzyl-3-(4-fluorophenyl)-1-(2-hydroxyethyl)thiourea
Property Insights of 1-Benzyl-3-(4-fluorophenyl)-1-(2-hydroxyethyl)thiourea
The XLogP value of 3.017 indicates that 1-Benzyl-3-(4-fluorophenyl)-1-(2-hydroxyethyl)thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, 1-Benzyl-3-(4-fluorophenyl)-1-(2-hydroxyethyl)thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Benzyl-3-(4-fluorophenyl)-1-(2-hydroxyethyl)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-Benzyl-3-(4-fluorophenyl)-1-(2-hydroxyethyl)thiourea?
The CAS number of 1-Benzyl-3-(4-fluorophenyl)-1-(2-hydroxyethyl)thiourea is 436109-99-8.
What is the molecular formula of 1-Benzyl-3-(4-fluorophenyl)-1-(2-hydroxyethyl)thiourea?
The molecular formula of 1-Benzyl-3-(4-fluorophenyl)-1-(2-hydroxyethyl)thiourea is C16H17FN2OS.
What is the molecular weight of 1-Benzyl-3-(4-fluorophenyl)-1-(2-hydroxyethyl)thiourea?
The molecular weight of 1-Benzyl-3-(4-fluorophenyl)-1-(2-hydroxyethyl)thiourea is 304.10 g/mol.
Where can I buy 1-Benzyl-3-(4-fluorophenyl)-1-(2-hydroxyethyl)thiourea?
You can request a quote for 1-Benzyl-3-(4-fluorophenyl)-1-(2-hydroxyethyl)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Benzyl-3-(4-fluorophenyl)-1-(2-hydroxyethyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-Benzyl-3-(4-fluorophenyl)-1-(2-hydroxyethyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.