N-(2-bromo-4-methylphenyl)-1,3-benzodioxole-5-carboxamide
TL;DR: N-(2-bromo-4-methylphenyl)-1,3-benzodioxole-5-carboxamide (CAS 560073-41-8) 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.
N-(2-bromo-4-methylphenyl)-1,3-benzodioxole-5-carboxamide
Also Known As: N-(2-bromo-4-methylphenyl)-1,3-benzodioxole-5-carboxamide, AN-668/13681014, 2H-benzo[3,4-d]1,3-dioxolan-5-yl-N-(2-bromo-4-methylphenyl)carboxamide, N-(2-BROMO-4-METHYLPHENYL)-2H-13-BENZODIOXOLE-5-CARBOXAMIDE, Cambridge id 7230502
| Molecular Formula | C15H12BrNO3 |
|---|---|
| Molecular Weight | 333.00 g/mol |
| LogP | 3.73852 |
| Topological Polar Surface Area | 47.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 333.00006 |
| Heavy Atoms | 20 |
| Complexity | 684.814 |
Chemical Identifiers
| CAS Number | 560073-41-8 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)NC(=O)C2=CC3=C(C=C2)OCO3)Br |
Product Overview
N-(2-bromo-4-methylphenyl)-1,3-benzodioxole-5-carboxamide (CAS 560073-41-8), with molecular formula C15H12BrNO3 and molecular weight 333.00 g/mol. IUPAC: N-(2-bromo-4-methylphenyl)-1,3-benzodioxole-5-carboxamide.
Chemical Property Profile of N-(2-bromo-4-methylphenyl)-1,3-benzodioxole-5-carboxamide
Property Insights of N-(2-bromo-4-methylphenyl)-1,3-benzodioxole-5-carboxamide
The XLogP value of 3.73852 indicates that N-(2-bromo-4-methylphenyl)-1,3-benzodioxole-5-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.56 Ų, N-(2-bromo-4-methylphenyl)-1,3-benzodioxole-5-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2-bromo-4-methylphenyl)-1,3-benzodioxole-5-carboxamide has 1 hydrogen bond donor(s) and 3 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-(2-bromo-4-methylphenyl)-1,3-benzodioxole-5-carboxamide?
The CAS number of N-(2-bromo-4-methylphenyl)-1,3-benzodioxole-5-carboxamide is 560073-41-8.
What is the molecular formula of N-(2-bromo-4-methylphenyl)-1,3-benzodioxole-5-carboxamide?
The molecular formula of N-(2-bromo-4-methylphenyl)-1,3-benzodioxole-5-carboxamide is C15H12BrNO3.
What is the molecular weight of N-(2-bromo-4-methylphenyl)-1,3-benzodioxole-5-carboxamide?
The molecular weight of N-(2-bromo-4-methylphenyl)-1,3-benzodioxole-5-carboxamide is 333.00 g/mol.
Where can I buy N-(2-bromo-4-methylphenyl)-1,3-benzodioxole-5-carboxamide?
You can request a quote for N-(2-bromo-4-methylphenyl)-1,3-benzodioxole-5-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-bromo-4-methylphenyl)-1,3-benzodioxole-5-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2-bromo-4-methylphenyl)-1,3-benzodioxole-5-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.