![1-[4-(2-Methylpropoxy)benzyl]thiourea structure](/static/products/374/37412-69-4.png)
1-[4-(2-Methylpropoxy)benzyl]thiourea
TL;DR: 1-[4-(2-Methylpropoxy)benzyl]thiourea (CAS 37412-69-4) is a chemical compound with molecular formula C12H18N2OS and molecular weight 238.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(2-methylpropoxy)phenyl]methylthiourea
Also Known As: 1-(4-isobutoxybenzyl)thiourea, 1-[4-(2-methylpropoxy)benzyl]thiourea, [4-(2-methylpropoxy)phenyl]methylthiourea
| Molecular Formula | C12H18N2OS |
|---|---|
| Molecular Weight | 238.11 g/mol |
| LogP | 2.0546 |
| Topological Polar Surface Area | 47.28 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 238.11398 |
| Heavy Atoms | 16 |
| Complexity | 335.37692 |
Chemical Identifiers
| CAS Number | 37412-69-4 |
|---|---|
| SMILES | CC(C)COC1=CC=C(C=C1)CNC(=S)N |
Product Overview
1-[4-(2-Methylpropoxy)benzyl]thiourea (CAS 37412-69-4), with molecular formula C12H18N2OS and molecular weight 238.11 g/mol. IUPAC: [4-(2-methylpropoxy)phenyl]methylthiourea.
Chemical Property Profile of 1-[4-(2-Methylpropoxy)benzyl]thiourea
Property Insights of 1-[4-(2-Methylpropoxy)benzyl]thiourea
The XLogP value of 2.0546 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[4-(2-Methylpropoxy)benzyl]thiourea. With a topological polar surface area (TPSA) of 47.28 Ų, 1-[4-(2-Methylpropoxy)benzyl]thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[4-(2-Methylpropoxy)benzyl]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-[4-(2-Methylpropoxy)benzyl]thiourea?
The CAS number of 1-[4-(2-Methylpropoxy)benzyl]thiourea is 37412-69-4.
What is the molecular formula of 1-[4-(2-Methylpropoxy)benzyl]thiourea?
The molecular formula of 1-[4-(2-Methylpropoxy)benzyl]thiourea is C12H18N2OS.
What is the molecular weight of 1-[4-(2-Methylpropoxy)benzyl]thiourea?
The molecular weight of 1-[4-(2-Methylpropoxy)benzyl]thiourea is 238.11 g/mol.
Where can I buy 1-[4-(2-Methylpropoxy)benzyl]thiourea?
You can request a quote for 1-[4-(2-Methylpropoxy)benzyl]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-(2-Methylpropoxy)benzyl]thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-[4-(2-Methylpropoxy)benzyl]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.