N-(7-acetyl-2,3-dihydro-1,4-benzodioxin-6-yl)-2-bromoacetamide
TL;DR: N-(7-acetyl-2,3-dihydro-1,4-benzodioxin-6-yl)-2-bromoacetamide (CAS 164526-18-5) is a chemical compound with molecular formula C12H12BrNO4 and molecular weight 312.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(7-acetyl-2,3-dihydro-1,4-benzodioxin-6-yl)-2-bromoacetamide
Also Known As: N-(7-acetyl-2,3-dihydro-1,4-benzodioxin-6-yl)-2-bromoacetamide
| Molecular Formula | C12H12BrNO4 |
|---|---|
| Molecular Weight | 312.99 g/mol |
| LogP | 1.9938 |
| Topological Polar Surface Area | 64.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 312.99496 |
| Heavy Atoms | 18 |
| Complexity | 501.09595 |
Chemical Identifiers
| CAS Number | 164526-18-5 |
|---|---|
| SMILES | CC(=O)C1=CC2=C(C=C1NC(=O)CBr)OCCO2 |
Product Overview
N-(7-acetyl-2,3-dihydro-1,4-benzodioxin-6-yl)-2-bromoacetamide (CAS 164526-18-5), with molecular formula C12H12BrNO4 and molecular weight 312.99 g/mol. IUPAC: N-(7-acetyl-2,3-dihydro-1,4-benzodioxin-6-yl)-2-bromoacetamide.
Chemical Property Profile of N-(7-acetyl-2,3-dihydro-1,4-benzodioxin-6-yl)-2-bromoacetamide
Property Insights of N-(7-acetyl-2,3-dihydro-1,4-benzodioxin-6-yl)-2-bromoacetamide
The XLogP value of 1.9938 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(7-acetyl-2,3-dihydro-1,4-benzodioxin-6-yl)-2-bromoacetamide. The TPSA of 64.63 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(7-acetyl-2,3-dihydro-1,4-benzodioxin-6-yl)-2-bromoacetamide. Following Lipinski's Rule of Five, N-(7-acetyl-2,3-dihydro-1,4-benzodioxin-6-yl)-2-bromoacetamide has 1 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-(7-acetyl-2,3-dihydro-1,4-benzodioxin-6-yl)-2-bromoacetamide?
The CAS number of N-(7-acetyl-2,3-dihydro-1,4-benzodioxin-6-yl)-2-bromoacetamide is 164526-18-5.
What is the molecular formula of N-(7-acetyl-2,3-dihydro-1,4-benzodioxin-6-yl)-2-bromoacetamide?
The molecular formula of N-(7-acetyl-2,3-dihydro-1,4-benzodioxin-6-yl)-2-bromoacetamide is C12H12BrNO4.
What is the molecular weight of N-(7-acetyl-2,3-dihydro-1,4-benzodioxin-6-yl)-2-bromoacetamide?
The molecular weight of N-(7-acetyl-2,3-dihydro-1,4-benzodioxin-6-yl)-2-bromoacetamide is 312.99 g/mol.
Where can I buy N-(7-acetyl-2,3-dihydro-1,4-benzodioxin-6-yl)-2-bromoacetamide?
You can request a quote for N-(7-acetyl-2,3-dihydro-1,4-benzodioxin-6-yl)-2-bromoacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(7-acetyl-2,3-dihydro-1,4-benzodioxin-6-yl)-2-bromoacetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(7-acetyl-2,3-dihydro-1,4-benzodioxin-6-yl)-2-bromoacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.