![1-[2-(2H-1,3-benzodioxol-5-yloxy)acetyl]-3-(propan-2-yl)urea structure](/static/products/878/878607-91-1.png)
1-[2-(2H-1,3-benzodioxol-5-yloxy)acetyl]-3-(propan-2-yl)urea
TL;DR: 1-[2-(2H-1,3-benzodioxol-5-yloxy)acetyl]-3-(propan-2-yl)urea (CAS 878607-91-1) is a chemical compound with molecular formula C13H16N2O5 and molecular weight 280.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-benzodioxol-5-yloxy)-N-(propan-2-ylcarbamoyl)acetamide
Also Known As: 1-[2-(2H-1,3-benzodioxol-5-yloxy)acetyl]-3-(propan-2-yl)urea, N-(2-(2H-benzo[3,4-d]1,3-dioxolen-5-yloxy)acetyl)[(methylethyl)amino]carboxami de
| Molecular Formula | C13H16N2O5 |
|---|---|
| Molecular Weight | 280.11 g/mol |
| LogP | 1.0283 |
| Topological Polar Surface Area | 85.89 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 280.10593 |
| Heavy Atoms | 20 |
| Complexity | 515.48303 |
Chemical Identifiers
| CAS Number | 878607-91-1 |
|---|---|
| SMILES | CC(C)NC(=O)NC(=O)COC1=CC2=C(C=C1)OCO2 |
Product Overview
1-[2-(2H-1,3-benzodioxol-5-yloxy)acetyl]-3-(propan-2-yl)urea (CAS 878607-91-1), with molecular formula C13H16N2O5 and molecular weight 280.11 g/mol. IUPAC: 2-(1,3-benzodioxol-5-yloxy)-N-(propan-2-ylcarbamoyl)acetamide.
Chemical Property Profile of 1-[2-(2H-1,3-benzodioxol-5-yloxy)acetyl]-3-(propan-2-yl)urea
Property Insights of 1-[2-(2H-1,3-benzodioxol-5-yloxy)acetyl]-3-(propan-2-yl)urea
The XLogP value of 1.0283 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[2-(2H-1,3-benzodioxol-5-yloxy)acetyl]-3-(propan-2-yl)urea. The TPSA of 85.89 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[2-(2H-1,3-benzodioxol-5-yloxy)acetyl]-3-(propan-2-yl)urea. Following Lipinski's Rule of Five, 1-[2-(2H-1,3-benzodioxol-5-yloxy)acetyl]-3-(propan-2-yl)urea has 2 hydrogen bond donor(s) and 5 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-[2-(2H-1,3-benzodioxol-5-yloxy)acetyl]-3-(propan-2-yl)urea?
The CAS number of 1-[2-(2H-1,3-benzodioxol-5-yloxy)acetyl]-3-(propan-2-yl)urea is 878607-91-1.
What is the molecular formula of 1-[2-(2H-1,3-benzodioxol-5-yloxy)acetyl]-3-(propan-2-yl)urea?
The molecular formula of 1-[2-(2H-1,3-benzodioxol-5-yloxy)acetyl]-3-(propan-2-yl)urea is C13H16N2O5.
What is the molecular weight of 1-[2-(2H-1,3-benzodioxol-5-yloxy)acetyl]-3-(propan-2-yl)urea?
The molecular weight of 1-[2-(2H-1,3-benzodioxol-5-yloxy)acetyl]-3-(propan-2-yl)urea is 280.11 g/mol.
Where can I buy 1-[2-(2H-1,3-benzodioxol-5-yloxy)acetyl]-3-(propan-2-yl)urea?
You can request a quote for 1-[2-(2H-1,3-benzodioxol-5-yloxy)acetyl]-3-(propan-2-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-[2-(2H-1,3-benzodioxol-5-yloxy)acetyl]-3-(propan-2-yl)urea?
Yes, KEHONG BIO provides custom synthesis services for 1-[2-(2H-1,3-benzodioxol-5-yloxy)acetyl]-3-(propan-2-yl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.