1-(3-Chloro-phenyl)-3-(3-oxo-1,3-dihydro-isobenzofuran-5-yl)-urea
TL;DR: 1-(3-Chloro-phenyl)-3-(3-oxo-1,3-dihydro-isobenzofuran-5-yl)-urea (CAS 298190-89-3) is a chemical compound with molecular formula C15H11ClN2O3 and molecular weight 302.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-chlorophenyl)-3-(3-oxo-1H-2-benzofuran-5-yl)urea
Also Known As: BAS 00538514, 1-(3-Chloro-phenyl)-3-(3-oxo-1,3-dihydro-isobenzofuran-5-yl)-urea, 1-(3-chlorophenyl)-3-(3-oxo-1H-2-benzofuran-5-yl)urea, N-(3-chlorophenyl)-N'-(3-oxo-1,3-dihydro-2-benzofuran-5-yl)urea
| Molecular Formula | C15H11ClN2O3 |
|---|---|
| Molecular Weight | 302.05 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 67.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 302.0458 |
| Heavy Atoms | 21 |
| Complexity | 418.0 |
Chemical Identifiers
| CAS Number | 298190-89-3 |
|---|---|
| SMILES | C1C2=C(C=C(C=C2)NC(=O)NC3=CC(=CC=C3)Cl)C(=O)O1 |
| InChIKey | YETUPWFUMNWUPM-UHFFFAOYSA-N |
Product Overview
1-(3-Chloro-phenyl)-3-(3-oxo-1,3-dihydro-isobenzofuran-5-yl)-urea (CAS 298190-89-3), with molecular formula C15H11ClN2O3 and molecular weight 302.05 g/mol. IUPAC: 1-(3-chlorophenyl)-3-(3-oxo-1H-2-benzofuran-5-yl)urea.
Chemical Property Profile of 1-(3-Chloro-phenyl)-3-(3-oxo-1,3-dihydro-isobenzofuran-5-yl)-urea
Property Insights of 1-(3-Chloro-phenyl)-3-(3-oxo-1,3-dihydro-isobenzofuran-5-yl)-urea
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3-Chloro-phenyl)-3-(3-oxo-1,3-dihydro-isobenzofuran-5-yl)-urea. The TPSA of 67.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(3-Chloro-phenyl)-3-(3-oxo-1,3-dihydro-isobenzofuran-5-yl)-urea. Following Lipinski's Rule of Five, 1-(3-Chloro-phenyl)-3-(3-oxo-1,3-dihydro-isobenzofuran-5-yl)-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-(3-Chloro-phenyl)-3-(3-oxo-1,3-dihydro-isobenzofuran-5-yl)-urea?
The CAS number of 1-(3-Chloro-phenyl)-3-(3-oxo-1,3-dihydro-isobenzofuran-5-yl)-urea is 298190-89-3.
What is the molecular formula of 1-(3-Chloro-phenyl)-3-(3-oxo-1,3-dihydro-isobenzofuran-5-yl)-urea?
The molecular formula of 1-(3-Chloro-phenyl)-3-(3-oxo-1,3-dihydro-isobenzofuran-5-yl)-urea is C15H11ClN2O3.
What is the molecular weight of 1-(3-Chloro-phenyl)-3-(3-oxo-1,3-dihydro-isobenzofuran-5-yl)-urea?
The molecular weight of 1-(3-Chloro-phenyl)-3-(3-oxo-1,3-dihydro-isobenzofuran-5-yl)-urea is 302.05 g/mol.
Where can I buy 1-(3-Chloro-phenyl)-3-(3-oxo-1,3-dihydro-isobenzofuran-5-yl)-urea?
You can request a quote for 1-(3-Chloro-phenyl)-3-(3-oxo-1,3-dihydro-isobenzofuran-5-yl)-urea 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-phenyl)-3-(3-oxo-1,3-dihydro-isobenzofuran-5-yl)-urea?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-Chloro-phenyl)-3-(3-oxo-1,3-dihydro-isobenzofuran-5-yl)-urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.