![1-[2-(3,4-Dimethoxyphenyl)ethyl]-3-(4-fluorophenyl)thiourea structure](/static/products/3133/313381-16-7.webp)
1-[2-(3,4-Dimethoxyphenyl)ethyl]-3-(4-fluorophenyl)thiourea
TL;DR: 1-[2-(3,4-Dimethoxyphenyl)ethyl]-3-(4-fluorophenyl)thiourea (CAS 313381-16-7) is a chemical compound with molecular formula C17H19FN2O2S and molecular weight 334.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(4-fluorophenyl)thiourea
Also Known As: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(4-fluorophenyl)thiourea, 1-(3,4-dimethoxyphenethyl)-3-(4-fluorophenyl)thiourea, N-(3,4-dimethoxyphenethyl)-N'-(4-fluorophenyl)thiourea, {[2-(3,4-dimethoxyphenyl)ethyl]amino}[(4-fluorophenyl)amino]methane-1-thione
| Molecular Formula | C17H19FN2O2S |
|---|---|
| Molecular Weight | 334.12 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 334.1151 |
| Heavy Atoms | 23 |
| Complexity | 365.0 |
Chemical Identifiers
| CAS Number | 313381-16-7 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CCNC(=S)NC2=CC=C(C=C2)F)OC |
| InChIKey | ZXNGMTFYMAUGAK-UHFFFAOYSA-N |
Product Overview
1-[2-(3,4-Dimethoxyphenyl)ethyl]-3-(4-fluorophenyl)thiourea (CAS 313381-16-7), with molecular formula C17H19FN2O2S and molecular weight 334.12 g/mol. IUPAC: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(4-fluorophenyl)thiourea.
Chemical Property Profile of 1-[2-(3,4-Dimethoxyphenyl)ethyl]-3-(4-fluorophenyl)thiourea
Property Insights of 1-[2-(3,4-Dimethoxyphenyl)ethyl]-3-(4-fluorophenyl)thiourea
The XLogP value of 3.1 indicates that 1-[2-(3,4-Dimethoxyphenyl)ethyl]-3-(4-fluorophenyl)thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[2-(3,4-Dimethoxyphenyl)ethyl]-3-(4-fluorophenyl)thiourea. Following Lipinski's Rule of Five, 1-[2-(3,4-Dimethoxyphenyl)ethyl]-3-(4-fluorophenyl)thiourea has 2 hydrogen bond donor(s) and 4 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-[2-(3,4-Dimethoxyphenyl)ethyl]-3-(4-fluorophenyl)thiourea?
The CAS number of 1-[2-(3,4-Dimethoxyphenyl)ethyl]-3-(4-fluorophenyl)thiourea is 313381-16-7.
What is the molecular formula of 1-[2-(3,4-Dimethoxyphenyl)ethyl]-3-(4-fluorophenyl)thiourea?
The molecular formula of 1-[2-(3,4-Dimethoxyphenyl)ethyl]-3-(4-fluorophenyl)thiourea is C17H19FN2O2S.
What is the molecular weight of 1-[2-(3,4-Dimethoxyphenyl)ethyl]-3-(4-fluorophenyl)thiourea?
The molecular weight of 1-[2-(3,4-Dimethoxyphenyl)ethyl]-3-(4-fluorophenyl)thiourea is 334.12 g/mol.
Where can I buy 1-[2-(3,4-Dimethoxyphenyl)ethyl]-3-(4-fluorophenyl)thiourea?
You can request a quote for 1-[2-(3,4-Dimethoxyphenyl)ethyl]-3-(4-fluorophenyl)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[2-(3,4-Dimethoxyphenyl)ethyl]-3-(4-fluorophenyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-[2-(3,4-Dimethoxyphenyl)ethyl]-3-(4-fluorophenyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.