N-(3-oxo-1,3-dihydro-2-benzofuran-1-yl)urea
TL;DR: N-(3-oxo-1,3-dihydro-2-benzofuran-1-yl)urea (CAS 4741-69-9) is a chemical compound with molecular formula C9H8N2O3 and molecular weight 192.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-oxo-1H-2-benzofuran-1-yl)urea
Also Known As: N-(3-oxo-1,3-dihydro-2-benzofuran-1-yl)urea, (3-oxo-1,3-dihydro-2-benzofuran-1-yl)urea, (3-oxo-1H-2-benzofuran-1-yl)urea, (3-oxo-1H-isobenzofuran-1-yl)urea, 3E-046
| Molecular Formula | C9H8N2O3 |
|---|---|
| Molecular Weight | 192.05 g/mol |
| LogP | 0.5239 |
| Topological Polar Surface Area | 81.42 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 192.0535 |
| Heavy Atoms | 14 |
| Complexity | 400.79846 |
Chemical Identifiers
| CAS Number | 4741-69-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(OC2=O)NC(=O)N |
Product Overview
N-(3-oxo-1,3-dihydro-2-benzofuran-1-yl)urea (CAS 4741-69-9), with molecular formula C9H8N2O3 and molecular weight 192.05 g/mol. IUPAC: (3-oxo-1H-2-benzofuran-1-yl)urea.
Chemical Property Profile of N-(3-oxo-1,3-dihydro-2-benzofuran-1-yl)urea
Property Insights of N-(3-oxo-1,3-dihydro-2-benzofuran-1-yl)urea
The XLogP value of 0.5239 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3-oxo-1,3-dihydro-2-benzofuran-1-yl)urea. The TPSA of 81.42 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3-oxo-1,3-dihydro-2-benzofuran-1-yl)urea. Following Lipinski's Rule of Five, N-(3-oxo-1,3-dihydro-2-benzofuran-1-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 N-(3-oxo-1,3-dihydro-2-benzofuran-1-yl)urea?
The CAS number of N-(3-oxo-1,3-dihydro-2-benzofuran-1-yl)urea is 4741-69-9.
What is the molecular formula of N-(3-oxo-1,3-dihydro-2-benzofuran-1-yl)urea?
The molecular formula of N-(3-oxo-1,3-dihydro-2-benzofuran-1-yl)urea is C9H8N2O3.
What is the molecular weight of N-(3-oxo-1,3-dihydro-2-benzofuran-1-yl)urea?
The molecular weight of N-(3-oxo-1,3-dihydro-2-benzofuran-1-yl)urea is 192.05 g/mol.
Where can I buy N-(3-oxo-1,3-dihydro-2-benzofuran-1-yl)urea?
You can request a quote for N-(3-oxo-1,3-dihydro-2-benzofuran-1-yl)urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-oxo-1,3-dihydro-2-benzofuran-1-yl)urea?
Yes, KEHONG BIO provides custom synthesis services for N-(3-oxo-1,3-dihydro-2-benzofuran-1-yl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.