1-(5-Acetyl-2-ethoxybenzyl)thiourea
TL;DR: 1-(5-Acetyl-2-ethoxybenzyl)thiourea (CAS 330182-48-4) is a chemical compound with molecular formula C12H16N2O2S and molecular weight 252.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5-acetyl-2-ethoxyphenyl)methylthiourea
Also Known As: 1-(5-acetyl-2-ethoxybenzyl)thiourea, (5-acetyl-2-ethoxyphenyl)methylthiourea
| Molecular Formula | C12H16N2O2S |
|---|---|
| Molecular Weight | 252.09 g/mol |
| LogP | 1.6211 |
| Topological Polar Surface Area | 64.35 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 252.09325 |
| Heavy Atoms | 17 |
| Complexity | 432.51385 |
Chemical Identifiers
| CAS Number | 330182-48-4 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)C(=O)C)CNC(=S)N |
Product Overview
1-(5-Acetyl-2-ethoxybenzyl)thiourea (CAS 330182-48-4), with molecular formula C12H16N2O2S and molecular weight 252.09 g/mol. IUPAC: (5-acetyl-2-ethoxyphenyl)methylthiourea.
Chemical Property Profile of 1-(5-Acetyl-2-ethoxybenzyl)thiourea
Property Insights of 1-(5-Acetyl-2-ethoxybenzyl)thiourea
The XLogP value of 1.6211 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(5-Acetyl-2-ethoxybenzyl)thiourea. The TPSA of 64.35 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(5-Acetyl-2-ethoxybenzyl)thiourea. Following Lipinski's Rule of Five, 1-(5-Acetyl-2-ethoxybenzyl)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-(5-Acetyl-2-ethoxybenzyl)thiourea?
The CAS number of 1-(5-Acetyl-2-ethoxybenzyl)thiourea is 330182-48-4.
What is the molecular formula of 1-(5-Acetyl-2-ethoxybenzyl)thiourea?
The molecular formula of 1-(5-Acetyl-2-ethoxybenzyl)thiourea is C12H16N2O2S.
What is the molecular weight of 1-(5-Acetyl-2-ethoxybenzyl)thiourea?
The molecular weight of 1-(5-Acetyl-2-ethoxybenzyl)thiourea is 252.09 g/mol.
Where can I buy 1-(5-Acetyl-2-ethoxybenzyl)thiourea?
You can request a quote for 1-(5-Acetyl-2-ethoxybenzyl)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(5-Acetyl-2-ethoxybenzyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(5-Acetyl-2-ethoxybenzyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.