![1-(1,3-Benzodioxol-5-yl)-3-[1-(4-methylphenyl)ethyl]urea structure](/static/products/894/894497-45-1.png)
1-(1,3-Benzodioxol-5-yl)-3-[1-(4-methylphenyl)ethyl]urea
TL;DR: 1-(1,3-Benzodioxol-5-yl)-3-[1-(4-methylphenyl)ethyl]urea (CAS 894497-45-1) is a chemical compound with molecular formula C17H18N2O3 and molecular weight 298.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1,3-benzodioxol-5-yl)-3-[1-(4-methylphenyl)ethyl]urea
Also Known As: 1-(1,3-benzodioxol-5-yl)-3-[1-(4-methylphenyl)ethyl]urea, 3-benzo[1,3]dioxol-5-yl-1-[1-(4-methylphenyl)ethyl]urea, N-(1,3-BENZODIOXOL-5-YL)-N'-[1-(4-METHYLPHENYL)ETHYL]UREA, (2H-benzo[3,4-d]1,3-dioxolan-5-ylamino)-N-[(4-methylphenyl)ethyl]carboxamide
| Molecular Formula | C17H18N2O3 |
|---|---|
| Molecular Weight | 298.13 g/mol |
| LogP | 3.60642 |
| Topological Polar Surface Area | 59.59 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 298.13174 |
| Heavy Atoms | 22 |
| Complexity | 682.80347 |
Chemical Identifiers
| CAS Number | 894497-45-1 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(C)NC(=O)NC2=CC3=C(C=C2)OCO3 |
Product Overview
1-(1,3-Benzodioxol-5-yl)-3-[1-(4-methylphenyl)ethyl]urea (CAS 894497-45-1), with molecular formula C17H18N2O3 and molecular weight 298.13 g/mol. IUPAC: 1-(1,3-benzodioxol-5-yl)-3-[1-(4-methylphenyl)ethyl]urea.
Chemical Property Profile of 1-(1,3-Benzodioxol-5-yl)-3-[1-(4-methylphenyl)ethyl]urea
Property Insights of 1-(1,3-Benzodioxol-5-yl)-3-[1-(4-methylphenyl)ethyl]urea
The XLogP value of 3.60642 indicates that 1-(1,3-Benzodioxol-5-yl)-3-[1-(4-methylphenyl)ethyl]urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.59 Ų, 1-(1,3-Benzodioxol-5-yl)-3-[1-(4-methylphenyl)ethyl]urea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(1,3-Benzodioxol-5-yl)-3-[1-(4-methylphenyl)ethyl]urea 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-(1,3-Benzodioxol-5-yl)-3-[1-(4-methylphenyl)ethyl]urea?
The CAS number of 1-(1,3-Benzodioxol-5-yl)-3-[1-(4-methylphenyl)ethyl]urea is 894497-45-1.
What is the molecular formula of 1-(1,3-Benzodioxol-5-yl)-3-[1-(4-methylphenyl)ethyl]urea?
The molecular formula of 1-(1,3-Benzodioxol-5-yl)-3-[1-(4-methylphenyl)ethyl]urea is C17H18N2O3.
What is the molecular weight of 1-(1,3-Benzodioxol-5-yl)-3-[1-(4-methylphenyl)ethyl]urea?
The molecular weight of 1-(1,3-Benzodioxol-5-yl)-3-[1-(4-methylphenyl)ethyl]urea is 298.13 g/mol.
Where can I buy 1-(1,3-Benzodioxol-5-yl)-3-[1-(4-methylphenyl)ethyl]urea?
You can request a quote for 1-(1,3-Benzodioxol-5-yl)-3-[1-(4-methylphenyl)ethyl]urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(1,3-Benzodioxol-5-yl)-3-[1-(4-methylphenyl)ethyl]urea?
Yes, KEHONG BIO provides custom synthesis services for 1-(1,3-Benzodioxol-5-yl)-3-[1-(4-methylphenyl)ethyl]urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.