1-(1,3-Benzodioxol-5-yl)-3-(3,4,5-trimethoxyphenyl)urea
TL;DR: 1-(1,3-Benzodioxol-5-yl)-3-(3,4,5-trimethoxyphenyl)urea (CAS 894226-83-6) is a chemical compound with molecular formula C17H18N2O6 and molecular weight 346.12 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-(3,4,5-trimethoxyphenyl)urea
Also Known As: 1-(1,3-benzodioxol-5-yl)-3-(3,4,5-trimethoxyphenyl)urea, N-1,3-benzodioxol-5-yl-N'-(3,4,5-trimethoxyphenyl)urea, N-(1,3-BENZODIOXOL-5-YL)-N'-(3,4,5-TRIMETHOXYPHENYL)UREA, (2H-benzo[3,4-d]1,3-dioxolan-5-ylamino)-N-(3,4,5-trimethoxyphenyl)carboxamide
| Molecular Formula | C17H18N2O6 |
|---|---|
| Molecular Weight | 346.12 g/mol |
| LogP | 3.0851 |
| Topological Polar Surface Area | 87.28 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 346.1165 |
| Heavy Atoms | 25 |
| Complexity | 767.6978 |
Chemical Identifiers
| CAS Number | 894226-83-6 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)NC(=O)NC2=CC3=C(C=C2)OCO3 |
Product Overview
1-(1,3-Benzodioxol-5-yl)-3-(3,4,5-trimethoxyphenyl)urea (CAS 894226-83-6), with molecular formula C17H18N2O6 and molecular weight 346.12 g/mol. IUPAC: 1-(1,3-benzodioxol-5-yl)-3-(3,4,5-trimethoxyphenyl)urea.
Chemical Property Profile of 1-(1,3-Benzodioxol-5-yl)-3-(3,4,5-trimethoxyphenyl)urea
Property Insights of 1-(1,3-Benzodioxol-5-yl)-3-(3,4,5-trimethoxyphenyl)urea
The XLogP value of 3.0851 indicates that 1-(1,3-Benzodioxol-5-yl)-3-(3,4,5-trimethoxyphenyl)urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.28 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(1,3-Benzodioxol-5-yl)-3-(3,4,5-trimethoxyphenyl)urea. Following Lipinski's Rule of Five, 1-(1,3-Benzodioxol-5-yl)-3-(3,4,5-trimethoxyphenyl)urea has 2 hydrogen bond donor(s) and 6 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-(3,4,5-trimethoxyphenyl)urea?
The CAS number of 1-(1,3-Benzodioxol-5-yl)-3-(3,4,5-trimethoxyphenyl)urea is 894226-83-6.
What is the molecular formula of 1-(1,3-Benzodioxol-5-yl)-3-(3,4,5-trimethoxyphenyl)urea?
The molecular formula of 1-(1,3-Benzodioxol-5-yl)-3-(3,4,5-trimethoxyphenyl)urea is C17H18N2O6.
What is the molecular weight of 1-(1,3-Benzodioxol-5-yl)-3-(3,4,5-trimethoxyphenyl)urea?
The molecular weight of 1-(1,3-Benzodioxol-5-yl)-3-(3,4,5-trimethoxyphenyl)urea is 346.12 g/mol.
Where can I buy 1-(1,3-Benzodioxol-5-yl)-3-(3,4,5-trimethoxyphenyl)urea?
You can request a quote for 1-(1,3-Benzodioxol-5-yl)-3-(3,4,5-trimethoxyphenyl)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-(3,4,5-trimethoxyphenyl)urea?
Yes, KEHONG BIO provides custom synthesis services for 1-(1,3-Benzodioxol-5-yl)-3-(3,4,5-trimethoxyphenyl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.