1-(3-Chloro-4-fluorophenyl)-3-prop-2-enylurea
TL;DR: 1-(3-Chloro-4-fluorophenyl)-3-prop-2-enylurea (CAS 893019-57-3) is a chemical compound with molecular formula C10H10ClFN2O and molecular weight 228.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-chloro-4-fluorophenyl)-3-prop-2-enylurea
Also Known As: N-allyl-N'-(3-chloro-4-fluorophenyl)urea, 1-(3-chloro-4-fluorophenyl)-3-prop-2-enylurea, 1-(3-chloro-4-fluoro-phenyl)-3-prop-2-enyl-urea, [(3-chloro-4-fluorophenyl)amino]-N-prop-2-enylcarboxamide
| Molecular Formula | C10H10ClFN2O |
|---|---|
| Molecular Weight | 228.05 g/mol |
| LogP | 2.7866 |
| Topological Polar Surface Area | 41.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 228.04657 |
| Heavy Atoms | 15 |
| Complexity | 381.68518 |
Chemical Identifiers
| CAS Number | 893019-57-3 |
|---|---|
| SMILES | C=CCNC(=O)NC1=CC(=C(C=C1)F)Cl |
Product Overview
1-(3-Chloro-4-fluorophenyl)-3-prop-2-enylurea (CAS 893019-57-3), with molecular formula C10H10ClFN2O and molecular weight 228.05 g/mol. IUPAC: 1-(3-chloro-4-fluorophenyl)-3-prop-2-enylurea.
Chemical Property Profile of 1-(3-Chloro-4-fluorophenyl)-3-prop-2-enylurea
Property Insights of 1-(3-Chloro-4-fluorophenyl)-3-prop-2-enylurea
The XLogP value of 2.7866 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3-Chloro-4-fluorophenyl)-3-prop-2-enylurea. With a topological polar surface area (TPSA) of 41.13 Ų, 1-(3-Chloro-4-fluorophenyl)-3-prop-2-enylurea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3-Chloro-4-fluorophenyl)-3-prop-2-enylurea has 2 hydrogen bond donor(s) and 1 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-(3-Chloro-4-fluorophenyl)-3-prop-2-enylurea?
The CAS number of 1-(3-Chloro-4-fluorophenyl)-3-prop-2-enylurea is 893019-57-3.
What is the molecular formula of 1-(3-Chloro-4-fluorophenyl)-3-prop-2-enylurea?
The molecular formula of 1-(3-Chloro-4-fluorophenyl)-3-prop-2-enylurea is C10H10ClFN2O.
What is the molecular weight of 1-(3-Chloro-4-fluorophenyl)-3-prop-2-enylurea?
The molecular weight of 1-(3-Chloro-4-fluorophenyl)-3-prop-2-enylurea is 228.05 g/mol.
Where can I buy 1-(3-Chloro-4-fluorophenyl)-3-prop-2-enylurea?
You can request a quote for 1-(3-Chloro-4-fluorophenyl)-3-prop-2-enylurea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3-Chloro-4-fluorophenyl)-3-prop-2-enylurea?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-Chloro-4-fluorophenyl)-3-prop-2-enylurea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.