(7-Amino-2,3-dihydro-1,4-benzodioxin-6-yl)(3-bromophenyl)methanone
TL;DR: (7-Amino-2,3-dihydro-1,4-benzodioxin-6-yl)(3-bromophenyl)methanone (CAS 727682-04-4) is a chemical compound with molecular formula C15H12BrNO3 and molecular weight 333.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6-amino-2,3-dihydro-1,4-benzodioxin-7-yl)-(3-bromophenyl)methanone
Also Known As: ZERO/004643, (7-amino-2,3-dihydro-1,4-benzodioxin-6-yl)(3-bromophenyl)methanone, (7-Amino-2,3-dihydrobenzo[b][1,4]dioxin-6-yl)(3-bromophenyl)methanone, (6-amino-2,3-dihydro-1,4-benzodioxin-7-yl)-(3-bromophenyl)methanone, (7-Amino-2,3-dihydro-benzo[1,4]dioxin-6-yl)-(3-bromo-phenyl)-methanone
| Molecular Formula | C15H12BrNO3 |
|---|---|
| Molecular Weight | 333.00 g/mol |
| LogP | 3.0335 |
| Topological Polar Surface Area | 61.55 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 333.00006 |
| Heavy Atoms | 20 |
| Complexity | 684.814 |
Chemical Identifiers
| CAS Number | 727682-04-4 |
|---|---|
| SMILES | C1COC2=C(O1)C=C(C(=C2)N)C(=O)C3=CC(=CC=C3)Br |
Product Overview
(7-Amino-2,3-dihydro-1,4-benzodioxin-6-yl)(3-bromophenyl)methanone (CAS 727682-04-4), with molecular formula C15H12BrNO3 and molecular weight 333.00 g/mol. IUPAC: (6-amino-2,3-dihydro-1,4-benzodioxin-7-yl)-(3-bromophenyl)methanone.
Chemical Property Profile of (7-Amino-2,3-dihydro-1,4-benzodioxin-6-yl)(3-bromophenyl)methanone
Property Insights of (7-Amino-2,3-dihydro-1,4-benzodioxin-6-yl)(3-bromophenyl)methanone
The XLogP value of 3.0335 indicates that (7-Amino-2,3-dihydro-1,4-benzodioxin-6-yl)(3-bromophenyl)methanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.55 Ų falls within the moderate polarity range, balancing permeability and solubility for (7-Amino-2,3-dihydro-1,4-benzodioxin-6-yl)(3-bromophenyl)methanone. Following Lipinski's Rule of Five, (7-Amino-2,3-dihydro-1,4-benzodioxin-6-yl)(3-bromophenyl)methanone 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 (7-Amino-2,3-dihydro-1,4-benzodioxin-6-yl)(3-bromophenyl)methanone?
The CAS number of (7-Amino-2,3-dihydro-1,4-benzodioxin-6-yl)(3-bromophenyl)methanone is 727682-04-4.
What is the molecular formula of (7-Amino-2,3-dihydro-1,4-benzodioxin-6-yl)(3-bromophenyl)methanone?
The molecular formula of (7-Amino-2,3-dihydro-1,4-benzodioxin-6-yl)(3-bromophenyl)methanone is C15H12BrNO3.
What is the molecular weight of (7-Amino-2,3-dihydro-1,4-benzodioxin-6-yl)(3-bromophenyl)methanone?
The molecular weight of (7-Amino-2,3-dihydro-1,4-benzodioxin-6-yl)(3-bromophenyl)methanone is 333.00 g/mol.
Where can I buy (7-Amino-2,3-dihydro-1,4-benzodioxin-6-yl)(3-bromophenyl)methanone?
You can request a quote for (7-Amino-2,3-dihydro-1,4-benzodioxin-6-yl)(3-bromophenyl)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (7-Amino-2,3-dihydro-1,4-benzodioxin-6-yl)(3-bromophenyl)methanone?
Yes, KEHONG BIO provides custom synthesis services for (7-Amino-2,3-dihydro-1,4-benzodioxin-6-yl)(3-bromophenyl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.