1-(3-Methoxybenzyl)-3-(4-phenoxyphenyl)thiourea
TL;DR: 1-(3-Methoxybenzyl)-3-(4-phenoxyphenyl)thiourea (CAS 516459-30-6) is a chemical compound with molecular formula C21H20N2O2S and molecular weight 364.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(3-methoxyphenyl)methyl]-3-(4-phenoxyphenyl)thiourea
Also Known As: 1-(3-methoxybenzyl)-3-(4-phenoxyphenyl)thiourea, 1-[(3-methoxyphenyl)methyl]-3-(4-phenoxyphenyl)thiourea, N-(3-METHOXYBENZYL)-N'-(4-PHENOXYPHENYL)THIOUREA, {[(3-methoxyphenyl)methyl]amino}[(4-phenoxyphenyl)amino]methane-1-thione
| Molecular Formula | C21H20N2O2S |
|---|---|
| Molecular Weight | 364.12 g/mol |
| LogP | 4.9741 |
| Topological Polar Surface Area | 42.52 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 364.12454 |
| Heavy Atoms | 26 |
| Complexity | 851.3997 |
Chemical Identifiers
| CAS Number | 516459-30-6 |
|---|---|
| SMILES | COC1=CC=CC(=C1)CNC(=S)NC2=CC=C(C=C2)OC3=CC=CC=C3 |
Product Overview
1-(3-Methoxybenzyl)-3-(4-phenoxyphenyl)thiourea (CAS 516459-30-6), with molecular formula C21H20N2O2S and molecular weight 364.12 g/mol. IUPAC: 1-[(3-methoxyphenyl)methyl]-3-(4-phenoxyphenyl)thiourea.
Chemical Property Profile of 1-(3-Methoxybenzyl)-3-(4-phenoxyphenyl)thiourea
Property Insights of 1-(3-Methoxybenzyl)-3-(4-phenoxyphenyl)thiourea
The XLogP value of 4.9741 indicates that 1-(3-Methoxybenzyl)-3-(4-phenoxyphenyl)thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.52 Ų, 1-(3-Methoxybenzyl)-3-(4-phenoxyphenyl)thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3-Methoxybenzyl)-3-(4-phenoxyphenyl)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-Methoxybenzyl)-3-(4-phenoxyphenyl)thiourea?
The CAS number of 1-(3-Methoxybenzyl)-3-(4-phenoxyphenyl)thiourea is 516459-30-6.
What is the molecular formula of 1-(3-Methoxybenzyl)-3-(4-phenoxyphenyl)thiourea?
The molecular formula of 1-(3-Methoxybenzyl)-3-(4-phenoxyphenyl)thiourea is C21H20N2O2S.
What is the molecular weight of 1-(3-Methoxybenzyl)-3-(4-phenoxyphenyl)thiourea?
The molecular weight of 1-(3-Methoxybenzyl)-3-(4-phenoxyphenyl)thiourea is 364.12 g/mol.
Where can I buy 1-(3-Methoxybenzyl)-3-(4-phenoxyphenyl)thiourea?
You can request a quote for 1-(3-Methoxybenzyl)-3-(4-phenoxyphenyl)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-Methoxybenzyl)-3-(4-phenoxyphenyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-Methoxybenzyl)-3-(4-phenoxyphenyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.