1-(3,4-Dimethoxyphenyl)-3-(1-pyridin-4-ylethyl)thiourea
TL;DR: 1-(3,4-Dimethoxyphenyl)-3-(1-pyridin-4-ylethyl)thiourea (CAS 706774-34-7) is a chemical compound with molecular formula C16H19N3O2S and molecular weight 317.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3,4-dimethoxyphenyl)-3-(1-pyridin-4-ylethyl)thiourea
Also Known As: 1-(3,4-dimethoxyphenyl)-3-(1-pyridin-4-ylethyl)thiourea, 1-(3,4-dimethoxyphenyl)-3-[1-(pyridin-4-yl)ethyl]thiourea, N-(3,4-dimethoxyphenyl)-N'-[1-(4-pyridinyl)ethyl]thiourea, [(3,4-dimethoxyphenyl)amino][(4-pyridylethyl)amino]methane-1-thione
| Molecular Formula | C16H19N3O2S |
|---|---|
| Molecular Weight | 317.12 g/mol |
| LogP | 3.1464 |
| Topological Polar Surface Area | 55.41 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 317.1198 |
| Heavy Atoms | 22 |
| Complexity | 634.54297 |
Chemical Identifiers
| CAS Number | 706774-34-7 |
|---|---|
| SMILES | CC(C1=CC=NC=C1)NC(=S)NC2=CC(=C(C=C2)OC)OC |
Product Overview
1-(3,4-Dimethoxyphenyl)-3-(1-pyridin-4-ylethyl)thiourea (CAS 706774-34-7), with molecular formula C16H19N3O2S and molecular weight 317.12 g/mol. IUPAC: 1-(3,4-dimethoxyphenyl)-3-(1-pyridin-4-ylethyl)thiourea.
Chemical Property Profile of 1-(3,4-Dimethoxyphenyl)-3-(1-pyridin-4-ylethyl)thiourea
Property Insights of 1-(3,4-Dimethoxyphenyl)-3-(1-pyridin-4-ylethyl)thiourea
The XLogP value of 3.1464 indicates that 1-(3,4-Dimethoxyphenyl)-3-(1-pyridin-4-ylethyl)thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.41 Ų, 1-(3,4-Dimethoxyphenyl)-3-(1-pyridin-4-ylethyl)thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3,4-Dimethoxyphenyl)-3-(1-pyridin-4-ylethyl)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-(3,4-Dimethoxyphenyl)-3-(1-pyridin-4-ylethyl)thiourea?
The CAS number of 1-(3,4-Dimethoxyphenyl)-3-(1-pyridin-4-ylethyl)thiourea is 706774-34-7.
What is the molecular formula of 1-(3,4-Dimethoxyphenyl)-3-(1-pyridin-4-ylethyl)thiourea?
The molecular formula of 1-(3,4-Dimethoxyphenyl)-3-(1-pyridin-4-ylethyl)thiourea is C16H19N3O2S.
What is the molecular weight of 1-(3,4-Dimethoxyphenyl)-3-(1-pyridin-4-ylethyl)thiourea?
The molecular weight of 1-(3,4-Dimethoxyphenyl)-3-(1-pyridin-4-ylethyl)thiourea is 317.12 g/mol.
Where can I buy 1-(3,4-Dimethoxyphenyl)-3-(1-pyridin-4-ylethyl)thiourea?
You can request a quote for 1-(3,4-Dimethoxyphenyl)-3-(1-pyridin-4-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-(3,4-Dimethoxyphenyl)-3-(1-pyridin-4-ylethyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(3,4-Dimethoxyphenyl)-3-(1-pyridin-4-ylethyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.