1-(1,3-Benzodioxol-5-yl)-3-(4-chloro-2-fluorophenyl)urea
TL;DR: 1-(1,3-Benzodioxol-5-yl)-3-(4-chloro-2-fluorophenyl)urea (CAS 897323-25-0) is a chemical compound with molecular formula C14H10ClFN2O3 and molecular weight 308.04 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-(4-chloro-2-fluorophenyl)urea
Also Known As: 1-(1,3-benzodioxol-5-yl)-3-(4-chloro-2-fluorophenyl)urea, 1-benzo[1,3]dioxol-5-yl-3-(4-chloro-2-fluoro-phenyl)urea, N-(1,3-BENZODIOXOL-5-YL)-N'-(4-CHLORO-2-FLUOROPHENYL)UREA, (2H-benzo[3,4-d]1,3-dioxolan-5-ylamino)-N-(4-chloro-2-fluorophenyl)carboxamide
| Molecular Formula | C14H10ClFN2O3 |
|---|---|
| Molecular Weight | 308.04 g/mol |
| LogP | 3.8518 |
| Topological Polar Surface Area | 59.59 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 308.0364 |
| Heavy Atoms | 21 |
| Complexity | 708.61365 |
Chemical Identifiers
| CAS Number | 897323-25-0 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)NC(=O)NC3=C(C=C(C=C3)Cl)F |
Product Overview
1-(1,3-Benzodioxol-5-yl)-3-(4-chloro-2-fluorophenyl)urea (CAS 897323-25-0), with molecular formula C14H10ClFN2O3 and molecular weight 308.04 g/mol. IUPAC: 1-(1,3-benzodioxol-5-yl)-3-(4-chloro-2-fluorophenyl)urea.
Chemical Property Profile of 1-(1,3-Benzodioxol-5-yl)-3-(4-chloro-2-fluorophenyl)urea
Property Insights of 1-(1,3-Benzodioxol-5-yl)-3-(4-chloro-2-fluorophenyl)urea
The XLogP value of 3.8518 indicates that 1-(1,3-Benzodioxol-5-yl)-3-(4-chloro-2-fluorophenyl)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-(4-chloro-2-fluorophenyl)urea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(1,3-Benzodioxol-5-yl)-3-(4-chloro-2-fluorophenyl)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-(4-chloro-2-fluorophenyl)urea?
The CAS number of 1-(1,3-Benzodioxol-5-yl)-3-(4-chloro-2-fluorophenyl)urea is 897323-25-0.
What is the molecular formula of 1-(1,3-Benzodioxol-5-yl)-3-(4-chloro-2-fluorophenyl)urea?
The molecular formula of 1-(1,3-Benzodioxol-5-yl)-3-(4-chloro-2-fluorophenyl)urea is C14H10ClFN2O3.
What is the molecular weight of 1-(1,3-Benzodioxol-5-yl)-3-(4-chloro-2-fluorophenyl)urea?
The molecular weight of 1-(1,3-Benzodioxol-5-yl)-3-(4-chloro-2-fluorophenyl)urea is 308.04 g/mol.
Where can I buy 1-(1,3-Benzodioxol-5-yl)-3-(4-chloro-2-fluorophenyl)urea?
You can request a quote for 1-(1,3-Benzodioxol-5-yl)-3-(4-chloro-2-fluorophenyl)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-(4-chloro-2-fluorophenyl)urea?
Yes, KEHONG BIO provides custom synthesis services for 1-(1,3-Benzodioxol-5-yl)-3-(4-chloro-2-fluorophenyl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.