Urea, N-(4-chlorophenyl)-N'-(4-oxo-4H-1-benzopyran-2-yl)-
TL;DR: Urea, N-(4-chlorophenyl)-N'-(4-oxo-4H-1-benzopyran-2-yl)- (CAS 59629-53-7) is a chemical compound with molecular formula C16H11ClN2O3 and molecular weight 314.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chlorophenyl)-3-(4-oxochromen-2-yl)urea
Also Known As: N-(4-Chlorophenyl)-N'-(4-oxo-4H-1-benzopyran-2-yl)urea, Urea, N-(4-chlorophenyl)-N'-(4-oxo-4H-1-benzopyran-2-yl)-, 1-(4-chlorophenyl)-3-(4-oxochromen-2-yl)urea, BRN 1656637, RefChem:388040
| Molecular Formula | C16H11ClN2O3 |
|---|---|
| Molecular Weight | 314.05 g/mol |
| LogP | 4.0904 |
| Topological Polar Surface Area | 71.34 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 314.0458 |
| Heavy Atoms | 22 |
| Complexity | 887.78156 |
Chemical Identifiers
| CAS Number | 59629-53-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)C=C(O2)NC(=O)NC3=CC=C(C=C3)Cl |
Product Overview
Urea, N-(4-chlorophenyl)-N'-(4-oxo-4H-1-benzopyran-2-yl)- (CAS 59629-53-7), with molecular formula C16H11ClN2O3 and molecular weight 314.05 g/mol. IUPAC: 1-(4-chlorophenyl)-3-(4-oxochromen-2-yl)urea.
Chemical Property Profile of Urea, N-(4-chlorophenyl)-N'-(4-oxo-4H-1-benzopyran-2-yl)-
Property Insights of Urea, N-(4-chlorophenyl)-N'-(4-oxo-4H-1-benzopyran-2-yl)-
The XLogP value of 4.0904 indicates that Urea, N-(4-chlorophenyl)-N'-(4-oxo-4H-1-benzopyran-2-yl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.34 Ų falls within the moderate polarity range, balancing permeability and solubility for Urea, N-(4-chlorophenyl)-N'-(4-oxo-4H-1-benzopyran-2-yl)-. Following Lipinski's Rule of Five, Urea, N-(4-chlorophenyl)-N'-(4-oxo-4H-1-benzopyran-2-yl)- 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 Urea, N-(4-chlorophenyl)-N'-(4-oxo-4H-1-benzopyran-2-yl)-?
The CAS number of Urea, N-(4-chlorophenyl)-N'-(4-oxo-4H-1-benzopyran-2-yl)- is 59629-53-7.
What is the molecular formula of Urea, N-(4-chlorophenyl)-N'-(4-oxo-4H-1-benzopyran-2-yl)-?
The molecular formula of Urea, N-(4-chlorophenyl)-N'-(4-oxo-4H-1-benzopyran-2-yl)- is C16H11ClN2O3.
What is the molecular weight of Urea, N-(4-chlorophenyl)-N'-(4-oxo-4H-1-benzopyran-2-yl)-?
The molecular weight of Urea, N-(4-chlorophenyl)-N'-(4-oxo-4H-1-benzopyran-2-yl)- is 314.05 g/mol.
Where can I buy Urea, N-(4-chlorophenyl)-N'-(4-oxo-4H-1-benzopyran-2-yl)-?
You can request a quote for Urea, N-(4-chlorophenyl)-N'-(4-oxo-4H-1-benzopyran-2-yl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Urea, N-(4-chlorophenyl)-N'-(4-oxo-4H-1-benzopyran-2-yl)-?
Yes, KEHONG BIO provides custom synthesis services for Urea, N-(4-chlorophenyl)-N'-(4-oxo-4H-1-benzopyran-2-yl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.