1-Allyl-3-(4-phenoxyphenyl)thiourea
TL;DR: 1-Allyl-3-(4-phenoxyphenyl)thiourea (CAS 433253-68-0) is a chemical compound with molecular formula C16H16N2OS and molecular weight 284.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-phenoxyphenyl)-3-prop-2-enylthiourea
Also Known As: 1-allyl-3-(4-phenoxyphenyl)thiourea, 1-(4-phenoxyphenyl)-3-prop-2-enylthiourea, 1-(4-phenoxyphenyl)-3-prop-2-en-1-ylthiourea, 1-(4-phenoxyphenyl)-3-(prop-2-en-1-yl)thiourea, [(4-phenoxyphenyl)amino](prop-2-enylamino)methane-1-thione
| Molecular Formula | C16H16N2OS |
|---|---|
| Molecular Weight | 284.10 g/mol |
| LogP | 3.9513 |
| Topological Polar Surface Area | 33.29 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 284.09833 |
| Heavy Atoms | 20 |
| Complexity | 566.7906 |
Chemical Identifiers
| CAS Number | 433253-68-0 |
|---|---|
| SMILES | C=CCNC(=S)NC1=CC=C(C=C1)OC2=CC=CC=C2 |
Product Overview
1-Allyl-3-(4-phenoxyphenyl)thiourea (CAS 433253-68-0), with molecular formula C16H16N2OS and molecular weight 284.10 g/mol. IUPAC: 1-(4-phenoxyphenyl)-3-prop-2-enylthiourea.
Chemical Property Profile of 1-Allyl-3-(4-phenoxyphenyl)thiourea
Property Insights of 1-Allyl-3-(4-phenoxyphenyl)thiourea
The XLogP value of 3.9513 indicates that 1-Allyl-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 33.29 Ų, 1-Allyl-3-(4-phenoxyphenyl)thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Allyl-3-(4-phenoxyphenyl)thiourea has 2 hydrogen bond donor(s) and 2 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-Allyl-3-(4-phenoxyphenyl)thiourea?
The CAS number of 1-Allyl-3-(4-phenoxyphenyl)thiourea is 433253-68-0.
What is the molecular formula of 1-Allyl-3-(4-phenoxyphenyl)thiourea?
The molecular formula of 1-Allyl-3-(4-phenoxyphenyl)thiourea is C16H16N2OS.
What is the molecular weight of 1-Allyl-3-(4-phenoxyphenyl)thiourea?
The molecular weight of 1-Allyl-3-(4-phenoxyphenyl)thiourea is 284.10 g/mol.
Where can I buy 1-Allyl-3-(4-phenoxyphenyl)thiourea?
You can request a quote for 1-Allyl-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-Allyl-3-(4-phenoxyphenyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-Allyl-3-(4-phenoxyphenyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.