![N-(1,3-benzodioxol-5-yl)-N'-[3-(1H-imidazol-1-yl)propyl]urea structure](/static/products/6927/692732-94-8.webp)
N-(1,3-benzodioxol-5-yl)-N'-[3-(1H-imidazol-1-yl)propyl]urea
TL;DR: N-(1,3-benzodioxol-5-yl)-N'-[3-(1H-imidazol-1-yl)propyl]urea (CAS 692732-94-8) is a chemical compound with molecular formula C14H16N4O3 and molecular weight 288.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1,3-benzodioxol-5-yl)-3-(3-imidazol-1-ylpropyl)urea
Also Known As: N-(1,3-benzodioxol-5-yl)-N'-[3-(1H-imidazol-1-yl)propyl]urea, 1-(2H-1,3-benzodioxol-5-yl)-3-[3-(1H-imidazol-1-yl)propyl]urea, 1-(1,3-benzodioxol-5-yl)-3-(3-imidazol-1-ylpropyl)urea, 3-benzo[1,3]dioxol-5-yl-1-(3-imidazol-1-ylpropyl)urea
| Molecular Formula | C14H16N4O3 |
|---|---|
| Molecular Weight | 288.12 g/mol |
| LogP | 1.8236 |
| Topological Polar Surface Area | 77.41 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 288.12225 |
| Heavy Atoms | 21 |
| Complexity | 612.6866 |
Chemical Identifiers
| CAS Number | 692732-94-8 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)NC(=O)NCCCN3C=CN=C3 |
Product Overview
N-(1,3-benzodioxol-5-yl)-N'-[3-(1H-imidazol-1-yl)propyl]urea (CAS 692732-94-8), with molecular formula C14H16N4O3 and molecular weight 288.12 g/mol. IUPAC: 1-(1,3-benzodioxol-5-yl)-3-(3-imidazol-1-ylpropyl)urea.
Chemical Property Profile of N-(1,3-benzodioxol-5-yl)-N'-[3-(1H-imidazol-1-yl)propyl]urea
Property Insights of N-(1,3-benzodioxol-5-yl)-N'-[3-(1H-imidazol-1-yl)propyl]urea
The XLogP value of 1.8236 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(1,3-benzodioxol-5-yl)-N'-[3-(1H-imidazol-1-yl)propyl]urea. The TPSA of 77.41 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1,3-benzodioxol-5-yl)-N'-[3-(1H-imidazol-1-yl)propyl]urea. Following Lipinski's Rule of Five, N-(1,3-benzodioxol-5-yl)-N'-[3-(1H-imidazol-1-yl)propyl]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
Frequently Asked Questions
What is the CAS number of N-(1,3-benzodioxol-5-yl)-N'-[3-(1H-imidazol-1-yl)propyl]urea?
The CAS number of N-(1,3-benzodioxol-5-yl)-N'-[3-(1H-imidazol-1-yl)propyl]urea is 692732-94-8.
What is the molecular formula of N-(1,3-benzodioxol-5-yl)-N'-[3-(1H-imidazol-1-yl)propyl]urea?
The molecular formula of N-(1,3-benzodioxol-5-yl)-N'-[3-(1H-imidazol-1-yl)propyl]urea is C14H16N4O3.
What is the molecular weight of N-(1,3-benzodioxol-5-yl)-N'-[3-(1H-imidazol-1-yl)propyl]urea?
The molecular weight of N-(1,3-benzodioxol-5-yl)-N'-[3-(1H-imidazol-1-yl)propyl]urea is 288.12 g/mol.
Where can I buy N-(1,3-benzodioxol-5-yl)-N'-[3-(1H-imidazol-1-yl)propyl]urea?
You can request a quote for N-(1,3-benzodioxol-5-yl)-N'-[3-(1H-imidazol-1-yl)propyl]urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1,3-benzodioxol-5-yl)-N'-[3-(1H-imidazol-1-yl)propyl]urea?
Yes, KEHONG BIO provides custom synthesis services for N-(1,3-benzodioxol-5-yl)-N'-[3-(1H-imidazol-1-yl)propyl]urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.