1,3-Bis(2-fluorophenyl)-2-thiourea
TL;DR: 1,3-Bis(2-fluorophenyl)-2-thiourea (CAS 3704-83-4) is a chemical compound with molecular formula C13H10F2N2S and molecular weight 264.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-bis(2-fluorophenyl)thiourea
Also Known As: 1,3-bis(2-fluorophenyl)thiourea, Maybridge1_007666, N,N'-bis(2-fluorophenyl)thiourea, 1,3-bis(2-fluorophenyl)-2-thiourea, KST-1B3665
| Molecular Formula | C13H10F2N2S |
|---|---|
| Molecular Weight | 264.05 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 56.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 264.05328 |
| Heavy Atoms | 18 |
| Complexity | 262.0 |
Chemical Identifiers
| CAS Number | 3704-83-4 |
|---|---|
| SMILES | C1=CC=C(C(=C1)NC(=S)NC2=CC=CC=C2F)F |
| InChIKey | ZBMLHTDWAFZBDE-UHFFFAOYSA-N |
Product Overview
1,3-Bis(2-fluorophenyl)-2-thiourea (CAS 3704-83-4), with molecular formula C13H10F2N2S and molecular weight 264.05 g/mol. IUPAC: 1,3-bis(2-fluorophenyl)thiourea.
Chemical Property Profile of 1,3-Bis(2-fluorophenyl)-2-thiourea
Property Insights of 1,3-Bis(2-fluorophenyl)-2-thiourea
The XLogP value of 3.3 indicates that 1,3-Bis(2-fluorophenyl)-2-thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.2 Ų, 1,3-Bis(2-fluorophenyl)-2-thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Bis(2-fluorophenyl)-2-thiourea has 2 hydrogen bond donor(s) and 3 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 1,3-Bis(2-fluorophenyl)-2-thiourea?
The CAS number of 1,3-Bis(2-fluorophenyl)-2-thiourea is 3704-83-4.
What is the molecular formula of 1,3-Bis(2-fluorophenyl)-2-thiourea?
The molecular formula of 1,3-Bis(2-fluorophenyl)-2-thiourea is C13H10F2N2S.
What is the molecular weight of 1,3-Bis(2-fluorophenyl)-2-thiourea?
The molecular weight of 1,3-Bis(2-fluorophenyl)-2-thiourea is 264.05 g/mol.
Where can I buy 1,3-Bis(2-fluorophenyl)-2-thiourea?
You can request a quote for 1,3-Bis(2-fluorophenyl)-2-thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Bis(2-fluorophenyl)-2-thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Bis(2-fluorophenyl)-2-thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.