1-(3,4-Dimethoxyphenethyl)-3-(3-methoxyphenyl)thiourea
TL;DR: 1-(3,4-Dimethoxyphenethyl)-3-(3-methoxyphenyl)thiourea (CAS 260446-96-6) is a chemical compound with molecular formula C18H22N2O3S and molecular weight 346.14 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-(3-methoxyphenyl)thiourea
Also Known As: N-(3,4-dimethoxyphenethyl)-N'-(3-methoxyphenyl)thiourea, F1533-0346, 1-(3,4-dimethoxyphenethyl)-3-(3-methoxyphenyl)thiourea, 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3-methoxyphenyl)thiourea, 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(m-methoxyphenyl)thiourea
| Molecular Formula | C18H22N2O3S |
|---|---|
| Molecular Weight | 346.14 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 83.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 346.1351 |
| Heavy Atoms | 24 |
| Complexity | 383.0 |
Chemical Identifiers
| CAS Number | 260446-96-6 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CCNC(=S)NC2=CC(=CC=C2)OC)OC |
| InChIKey | VCPFDROXZPRPLI-UHFFFAOYSA-N |
Product Overview
1-(3,4-Dimethoxyphenethyl)-3-(3-methoxyphenyl)thiourea (CAS 260446-96-6), with molecular formula C18H22N2O3S and molecular weight 346.14 g/mol. IUPAC: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3-methoxyphenyl)thiourea.
Chemical Property Profile of 1-(3,4-Dimethoxyphenethyl)-3-(3-methoxyphenyl)thiourea
Property Insights of 1-(3,4-Dimethoxyphenethyl)-3-(3-methoxyphenyl)thiourea
The XLogP value of 3.4 indicates that 1-(3,4-Dimethoxyphenethyl)-3-(3-methoxyphenyl)thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(3,4-Dimethoxyphenethyl)-3-(3-methoxyphenyl)thiourea. Following Lipinski's Rule of Five, 1-(3,4-Dimethoxyphenethyl)-3-(3-methoxyphenyl)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-Dimethoxyphenethyl)-3-(3-methoxyphenyl)thiourea?
The CAS number of 1-(3,4-Dimethoxyphenethyl)-3-(3-methoxyphenyl)thiourea is 260446-96-6.
What is the molecular formula of 1-(3,4-Dimethoxyphenethyl)-3-(3-methoxyphenyl)thiourea?
The molecular formula of 1-(3,4-Dimethoxyphenethyl)-3-(3-methoxyphenyl)thiourea is C18H22N2O3S.
What is the molecular weight of 1-(3,4-Dimethoxyphenethyl)-3-(3-methoxyphenyl)thiourea?
The molecular weight of 1-(3,4-Dimethoxyphenethyl)-3-(3-methoxyphenyl)thiourea is 346.14 g/mol.
Where can I buy 1-(3,4-Dimethoxyphenethyl)-3-(3-methoxyphenyl)thiourea?
You can request a quote for 1-(3,4-Dimethoxyphenethyl)-3-(3-methoxyphenyl)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-Dimethoxyphenethyl)-3-(3-methoxyphenyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(3,4-Dimethoxyphenethyl)-3-(3-methoxyphenyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.