N-[7-(2-bromobenzoyl)-2,3-dihydro-1,4-benzodioxin-6-yl]butanamide
TL;DR: N-[7-(2-bromobenzoyl)-2,3-dihydro-1,4-benzodioxin-6-yl]butanamide (CAS 717862-22-1) is a chemical compound with molecular formula C19H18BrNO4 and molecular weight 403.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[7-(2-bromobenzoyl)-2,3-dihydro-1,4-benzodioxin-6-yl]butanamide
Also Known As: A3787/0160770, N-[7-(2-bromobenzoyl)-2,3-dihydro-1,4-benzodioxin-6-yl]butanamide, N-{7-[(2-bromophenyl)carbonyl]-2,3-dihydro-1,4-benzodioxin-6-yl}butanamide, N~1~-[7-(2-BROMOBENZOYL)-2,3-DIHYDRO-1,4-BENZODIOXIN-6-YL]BUTANAMIDE
| Molecular Formula | C19H18BrNO4 |
|---|---|
| Molecular Weight | 403.04 g/mol |
| LogP | 4.1899 |
| Topological Polar Surface Area | 64.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 403.04193 |
| Heavy Atoms | 25 |
| Complexity | 819.0665 |
Chemical Identifiers
| CAS Number | 717862-22-1 |
|---|---|
| SMILES | CCCC(=O)NC1=CC2=C(C=C1C(=O)C3=CC=CC=C3Br)OCCO2 |
Product Overview
N-[7-(2-bromobenzoyl)-2,3-dihydro-1,4-benzodioxin-6-yl]butanamide (CAS 717862-22-1), with molecular formula C19H18BrNO4 and molecular weight 403.04 g/mol. IUPAC: N-[7-(2-bromobenzoyl)-2,3-dihydro-1,4-benzodioxin-6-yl]butanamide.
Chemical Property Profile of N-[7-(2-bromobenzoyl)-2,3-dihydro-1,4-benzodioxin-6-yl]butanamide
Property Insights of N-[7-(2-bromobenzoyl)-2,3-dihydro-1,4-benzodioxin-6-yl]butanamide
The XLogP value of 4.1899 indicates that N-[7-(2-bromobenzoyl)-2,3-dihydro-1,4-benzodioxin-6-yl]butanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.63 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[7-(2-bromobenzoyl)-2,3-dihydro-1,4-benzodioxin-6-yl]butanamide. Following Lipinski's Rule of Five, N-[7-(2-bromobenzoyl)-2,3-dihydro-1,4-benzodioxin-6-yl]butanamide 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-(2-bromobenzoyl)-2,3-dihydro-1,4-benzodioxin-6-yl]butanamide?
The CAS number of N-[7-(2-bromobenzoyl)-2,3-dihydro-1,4-benzodioxin-6-yl]butanamide is 717862-22-1.
What is the molecular formula of N-[7-(2-bromobenzoyl)-2,3-dihydro-1,4-benzodioxin-6-yl]butanamide?
The molecular formula of N-[7-(2-bromobenzoyl)-2,3-dihydro-1,4-benzodioxin-6-yl]butanamide is C19H18BrNO4.
What is the molecular weight of N-[7-(2-bromobenzoyl)-2,3-dihydro-1,4-benzodioxin-6-yl]butanamide?
The molecular weight of N-[7-(2-bromobenzoyl)-2,3-dihydro-1,4-benzodioxin-6-yl]butanamide is 403.04 g/mol.
Where can I buy N-[7-(2-bromobenzoyl)-2,3-dihydro-1,4-benzodioxin-6-yl]butanamide?
You can request a quote for N-[7-(2-bromobenzoyl)-2,3-dihydro-1,4-benzodioxin-6-yl]butanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[7-(2-bromobenzoyl)-2,3-dihydro-1,4-benzodioxin-6-yl]butanamide?
Yes, KEHONG BIO provides custom synthesis services for N-[7-(2-bromobenzoyl)-2,3-dihydro-1,4-benzodioxin-6-yl]butanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.