1-Allyl-3-(2-ethoxyphenyl)-2-thiourea
TL;DR: 1-Allyl-3-(2-ethoxyphenyl)-2-thiourea (CAS 14255-93-7) is a chemical compound with molecular formula C12H16N2OS and molecular weight 236.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-ethoxyphenyl)-3-prop-2-enylthiourea
Also Known As: 1-allyl-3-(2-ethoxyphenyl)-2-thiourea, 1-Allyl-3-(2-ethoxyphenyl)thiourea, 1-(2-ethoxyphenyl)-3-prop-2-enylthiourea, 1-(2-ethoxyphenyl)-3-(prop-2-en-1-yl)thiourea, N-(2-Ethoxyphenyl)-N'-prop-2-en-1-ylthiourea
| Molecular Formula | C12H16N2OS |
|---|---|
| Molecular Weight | 236.10 g/mol |
| LogP | 2.5577 |
| Topological Polar Surface Area | 33.29 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 236.09833 |
| Heavy Atoms | 16 |
| Complexity | 365.79132 |
Chemical Identifiers
| CAS Number | 14255-93-7 |
|---|---|
| SMILES | CCOC1=CC=CC=C1NC(=S)NCC=C |
Product Overview
1-Allyl-3-(2-ethoxyphenyl)-2-thiourea (CAS 14255-93-7), with molecular formula C12H16N2OS and molecular weight 236.10 g/mol. IUPAC: 1-(2-ethoxyphenyl)-3-prop-2-enylthiourea.
Chemical Property Profile of 1-Allyl-3-(2-ethoxyphenyl)-2-thiourea
Property Insights of 1-Allyl-3-(2-ethoxyphenyl)-2-thiourea
The XLogP value of 2.5577 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Allyl-3-(2-ethoxyphenyl)-2-thiourea. With a topological polar surface area (TPSA) of 33.29 Ų, 1-Allyl-3-(2-ethoxyphenyl)-2-thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Allyl-3-(2-ethoxyphenyl)-2-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-(2-ethoxyphenyl)-2-thiourea?
The CAS number of 1-Allyl-3-(2-ethoxyphenyl)-2-thiourea is 14255-93-7.
What is the molecular formula of 1-Allyl-3-(2-ethoxyphenyl)-2-thiourea?
The molecular formula of 1-Allyl-3-(2-ethoxyphenyl)-2-thiourea is C12H16N2OS.
What is the molecular weight of 1-Allyl-3-(2-ethoxyphenyl)-2-thiourea?
The molecular weight of 1-Allyl-3-(2-ethoxyphenyl)-2-thiourea is 236.10 g/mol.
Where can I buy 1-Allyl-3-(2-ethoxyphenyl)-2-thiourea?
You can request a quote for 1-Allyl-3-(2-ethoxyphenyl)-2-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-(2-ethoxyphenyl)-2-thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-Allyl-3-(2-ethoxyphenyl)-2-thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.