1-(1,3-Benzodioxol-5-yl)-3-(5-chloro-2-methoxyphenyl)urea
TL;DR: 1-(1,3-Benzodioxol-5-yl)-3-(5-chloro-2-methoxyphenyl)urea (CAS 890586-92-2) is a chemical compound with molecular formula C15H13ClN2O4 and molecular weight 320.06 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-(5-chloro-2-methoxyphenyl)urea
Also Known As: 1-(1,3-benzodioxol-5-yl)-3-(5-chloro-2-methoxyphenyl)urea, N-(1,3-BENZODIOXOL-5-YL)-N'-(5-CHLORO-2-METHOXYPHENYL)UREA, N-(2H-benzo[3,4-d]1,3-dioxolan-5-yl)[(5-chloro-2-methoxyphenyl)amino]carboxami de
| Molecular Formula | C15H13ClN2O4 |
|---|---|
| Molecular Weight | 320.06 g/mol |
| LogP | 3.7213 |
| Topological Polar Surface Area | 68.82 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 320.0564 |
| Heavy Atoms | 22 |
| Complexity | 720.6838 |
Chemical Identifiers
| CAS Number | 890586-92-2 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)Cl)NC(=O)NC2=CC3=C(C=C2)OCO3 |
Product Overview
1-(1,3-Benzodioxol-5-yl)-3-(5-chloro-2-methoxyphenyl)urea (CAS 890586-92-2), with molecular formula C15H13ClN2O4 and molecular weight 320.06 g/mol. IUPAC: 1-(1,3-benzodioxol-5-yl)-3-(5-chloro-2-methoxyphenyl)urea.
Chemical Property Profile of 1-(1,3-Benzodioxol-5-yl)-3-(5-chloro-2-methoxyphenyl)urea
Property Insights of 1-(1,3-Benzodioxol-5-yl)-3-(5-chloro-2-methoxyphenyl)urea
The XLogP value of 3.7213 indicates that 1-(1,3-Benzodioxol-5-yl)-3-(5-chloro-2-methoxyphenyl)urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.82 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(1,3-Benzodioxol-5-yl)-3-(5-chloro-2-methoxyphenyl)urea. Following Lipinski's Rule of Five, 1-(1,3-Benzodioxol-5-yl)-3-(5-chloro-2-methoxyphenyl)urea has 2 hydrogen bond donor(s) and 4 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-(5-chloro-2-methoxyphenyl)urea?
The CAS number of 1-(1,3-Benzodioxol-5-yl)-3-(5-chloro-2-methoxyphenyl)urea is 890586-92-2.
What is the molecular formula of 1-(1,3-Benzodioxol-5-yl)-3-(5-chloro-2-methoxyphenyl)urea?
The molecular formula of 1-(1,3-Benzodioxol-5-yl)-3-(5-chloro-2-methoxyphenyl)urea is C15H13ClN2O4.
What is the molecular weight of 1-(1,3-Benzodioxol-5-yl)-3-(5-chloro-2-methoxyphenyl)urea?
The molecular weight of 1-(1,3-Benzodioxol-5-yl)-3-(5-chloro-2-methoxyphenyl)urea is 320.06 g/mol.
Where can I buy 1-(1,3-Benzodioxol-5-yl)-3-(5-chloro-2-methoxyphenyl)urea?
You can request a quote for 1-(1,3-Benzodioxol-5-yl)-3-(5-chloro-2-methoxyphenyl)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-(5-chloro-2-methoxyphenyl)urea?
Yes, KEHONG BIO provides custom synthesis services for 1-(1,3-Benzodioxol-5-yl)-3-(5-chloro-2-methoxyphenyl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.