1-(1,3-Benzodioxol-5-ylmethyl)-3-(3,4-dichlorophenyl)urea
TL;DR: 1-(1,3-Benzodioxol-5-ylmethyl)-3-(3,4-dichlorophenyl)urea (CAS 65609-35-0) is a chemical compound with molecular formula C15H12Cl2N2O3 and molecular weight 338.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1,3-benzodioxol-5-ylmethyl)-3-(3,4-dichlorophenyl)urea
Also Known As: BAS 01923398, BIM-0045212.P001, 1-(1,3-benzodioxol-5-ylmethyl)-3-(3,4-dichlorophenyl)urea, BRD-K90882246-001-01-9, N-(1,3-benzodioxol-5-ylmethyl)-N'-(3,4-dichlorophenyl)urea
| Molecular Formula | C15H12Cl2N2O3 |
|---|---|
| Molecular Weight | 338.02 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 59.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 338.0225 |
| Heavy Atoms | 22 |
| Complexity | 399.0 |
Chemical Identifiers
| CAS Number | 65609-35-0 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)CNC(=O)NC3=CC(=C(C=C3)Cl)Cl |
| InChIKey | JXPBXLYFTNHGFE-UHFFFAOYSA-N |
Product Overview
1-(1,3-Benzodioxol-5-ylmethyl)-3-(3,4-dichlorophenyl)urea (CAS 65609-35-0), with molecular formula C15H12Cl2N2O3 and molecular weight 338.02 g/mol. IUPAC: 1-(1,3-benzodioxol-5-ylmethyl)-3-(3,4-dichlorophenyl)urea.
Chemical Property Profile of 1-(1,3-Benzodioxol-5-ylmethyl)-3-(3,4-dichlorophenyl)urea
Property Insights of 1-(1,3-Benzodioxol-5-ylmethyl)-3-(3,4-dichlorophenyl)urea
The XLogP value of 3.5 indicates that 1-(1,3-Benzodioxol-5-ylmethyl)-3-(3,4-dichlorophenyl)urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.6 Ų, 1-(1,3-Benzodioxol-5-ylmethyl)-3-(3,4-dichlorophenyl)urea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(1,3-Benzodioxol-5-ylmethyl)-3-(3,4-dichlorophenyl)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-ylmethyl)-3-(3,4-dichlorophenyl)urea?
The CAS number of 1-(1,3-Benzodioxol-5-ylmethyl)-3-(3,4-dichlorophenyl)urea is 65609-35-0.
What is the molecular formula of 1-(1,3-Benzodioxol-5-ylmethyl)-3-(3,4-dichlorophenyl)urea?
The molecular formula of 1-(1,3-Benzodioxol-5-ylmethyl)-3-(3,4-dichlorophenyl)urea is C15H12Cl2N2O3.
What is the molecular weight of 1-(1,3-Benzodioxol-5-ylmethyl)-3-(3,4-dichlorophenyl)urea?
The molecular weight of 1-(1,3-Benzodioxol-5-ylmethyl)-3-(3,4-dichlorophenyl)urea is 338.02 g/mol.
Where can I buy 1-(1,3-Benzodioxol-5-ylmethyl)-3-(3,4-dichlorophenyl)urea?
You can request a quote for 1-(1,3-Benzodioxol-5-ylmethyl)-3-(3,4-dichlorophenyl)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-ylmethyl)-3-(3,4-dichlorophenyl)urea?
Yes, KEHONG BIO provides custom synthesis services for 1-(1,3-Benzodioxol-5-ylmethyl)-3-(3,4-dichlorophenyl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.