1-(4-Methylphenyl)-3-(3-phenylmethoxypyridin-2-yl)thiourea
TL;DR: 1-(4-Methylphenyl)-3-(3-phenylmethoxypyridin-2-yl)thiourea (CAS 491867-72-2) is a chemical compound with molecular formula C20H19N3OS and molecular weight 349.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-methylphenyl)-3-(3-phenylmethoxy-2-pyridinyl)thiourea
Also Known As: 1-(3-benzyloxy-2-pyridyl)-3-(p-tolyl)thiourea, 1-(4-methylphenyl)-3-(3-phenylmethoxypyridin-2-yl)thiourea, 3-[3-(benzyloxy)pyridin-2-yl]-1-(4-methylphenyl)thiourea, AO-990/40758252, ((4-METHYLPHENYL)AMINO)((3-(PHENYLMETHOXY)(2-PYRIDYL))AMINO)METHANE-1-THIONE
| Molecular Formula | C20H19N3OS |
|---|---|
| Molecular Weight | 349.12 g/mol |
| LogP | 4.77792 |
| Topological Polar Surface Area | 46.18 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 349.12488 |
| Heavy Atoms | 25 |
| Complexity | 835.0748 |
Chemical Identifiers
| CAS Number | 491867-72-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC(=S)NC2=C(C=CC=N2)OCC3=CC=CC=C3 |
Product Overview
1-(4-Methylphenyl)-3-(3-phenylmethoxypyridin-2-yl)thiourea (CAS 491867-72-2), with molecular formula C20H19N3OS and molecular weight 349.12 g/mol. IUPAC: 1-(4-methylphenyl)-3-(3-phenylmethoxy-2-pyridinyl)thiourea.
Chemical Property Profile of 1-(4-Methylphenyl)-3-(3-phenylmethoxypyridin-2-yl)thiourea
Property Insights of 1-(4-Methylphenyl)-3-(3-phenylmethoxypyridin-2-yl)thiourea
The XLogP value of 4.77792 indicates that 1-(4-Methylphenyl)-3-(3-phenylmethoxypyridin-2-yl)thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.18 Ų, 1-(4-Methylphenyl)-3-(3-phenylmethoxypyridin-2-yl)thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Methylphenyl)-3-(3-phenylmethoxypyridin-2-yl)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-(4-Methylphenyl)-3-(3-phenylmethoxypyridin-2-yl)thiourea?
The CAS number of 1-(4-Methylphenyl)-3-(3-phenylmethoxypyridin-2-yl)thiourea is 491867-72-2.
What is the molecular formula of 1-(4-Methylphenyl)-3-(3-phenylmethoxypyridin-2-yl)thiourea?
The molecular formula of 1-(4-Methylphenyl)-3-(3-phenylmethoxypyridin-2-yl)thiourea is C20H19N3OS.
What is the molecular weight of 1-(4-Methylphenyl)-3-(3-phenylmethoxypyridin-2-yl)thiourea?
The molecular weight of 1-(4-Methylphenyl)-3-(3-phenylmethoxypyridin-2-yl)thiourea is 349.12 g/mol.
Where can I buy 1-(4-Methylphenyl)-3-(3-phenylmethoxypyridin-2-yl)thiourea?
You can request a quote for 1-(4-Methylphenyl)-3-(3-phenylmethoxypyridin-2-yl)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Methylphenyl)-3-(3-phenylmethoxypyridin-2-yl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Methylphenyl)-3-(3-phenylmethoxypyridin-2-yl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.