1-Furfuryl-3-(4-nitrophenyl)urea
TL;DR: 1-Furfuryl-3-(4-nitrophenyl)urea (CAS 154825-26-0) is a chemical compound with molecular formula C12H11N3O4 and molecular weight 261.07495 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(furan-2-ylmethyl)-3-(4-nitrophenyl)urea
Also Known As: N-(2-furylmethyl)-N'-(4-nitrophenyl)urea, 1-(furan-2-ylmethyl)-3-(4-nitrophenyl)urea, 1-FURFURYL-3-(4-NITROPHENYL)UREA, 3-(furan-2-ylmethyl)-1-(4-nitrophenyl)urea, 1-(2-furylmethyl)-3-(4-nitrophenyl)urea
Technical Specifications
| Molecular Formula | C12H11N3O4 |
| Molecular Weight | 261.07495 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 100.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 261.07495 Da |
| Heavy Atoms | 19 |
| Complexity | 323.0 |
| Solubility | 16.5 [ug/mL] (The mean of the results at pH 7.4) |
| SMILES | C1=COC(=C1)CNC(=O)NC2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | NVNKQKPUEKQJRM-UHFFFAOYSA-N |
Chemical Property Profile of 1-Furfuryl-3-(4-nitrophenyl)urea
Property Insights of 1-Furfuryl-3-(4-nitrophenyl)urea
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Furfuryl-3-(4-nitrophenyl)urea. The TPSA of 100.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Furfuryl-3-(4-nitrophenyl)urea. Following Lipinski's Rule of Five, 1-Furfuryl-3-(4-nitrophenyl)urea has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-Furfuryl-3-(4-nitrophenyl)urea?
The CAS number of 1-Furfuryl-3-(4-nitrophenyl)urea is 154825-26-0.
What is the molecular formula of 1-Furfuryl-3-(4-nitrophenyl)urea?
The molecular formula of 1-Furfuryl-3-(4-nitrophenyl)urea is C12H11N3O4.
What is the molecular weight of 1-Furfuryl-3-(4-nitrophenyl)urea?
The molecular weight of 1-Furfuryl-3-(4-nitrophenyl)urea is 261.07495 g/mol.
Where can I buy 1-Furfuryl-3-(4-nitrophenyl)urea?
You can request a quote for 1-Furfuryl-3-(4-nitrophenyl)urea directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Furfuryl-3-(4-nitrophenyl)urea?
Yes, CoreyChem provides custom synthesis services for 1-Furfuryl-3-(4-nitrophenyl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.