6-bromo-N-phenyl-1,3-benzodioxole-5-carboxamide
TL;DR: 6-bromo-N-phenyl-1,3-benzodioxole-5-carboxamide (CAS 339267-17-3) is a chemical compound with molecular formula C14H10BrNO3 and molecular weight 318.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-bromo-N-phenyl-1,3-benzodioxole-5-carboxamide
Also Known As: 6-bromo-N-phenyl-1,3-benzodioxole-5-carboxamide, J1.506.552D, AP-065/41884120, N-Phenyl-6-bromo-1,3-benzodioxole-5-carboxamide, 6-bromo-N-phenyl-2H-1,3-benzodioxole-5-carboxamide
| Molecular Formula | C14H10BrNO3 |
|---|---|
| Molecular Weight | 318.98 g/mol |
| LogP | 3.4301 |
| Topological Polar Surface Area | 47.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 318.9844 |
| Heavy Atoms | 19 |
| Complexity | 628.08826 |
Chemical Identifiers
| CAS Number | 339267-17-3 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C(=C2)C(=O)NC3=CC=CC=C3)Br |
Product Overview
6-bromo-N-phenyl-1,3-benzodioxole-5-carboxamide (CAS 339267-17-3), with molecular formula C14H10BrNO3 and molecular weight 318.98 g/mol. IUPAC: 6-bromo-N-phenyl-1,3-benzodioxole-5-carboxamide.
Chemical Property Profile of 6-bromo-N-phenyl-1,3-benzodioxole-5-carboxamide
Property Insights of 6-bromo-N-phenyl-1,3-benzodioxole-5-carboxamide
The XLogP value of 3.4301 indicates that 6-bromo-N-phenyl-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, 6-bromo-N-phenyl-1,3-benzodioxole-5-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-bromo-N-phenyl-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 6-bromo-N-phenyl-1,3-benzodioxole-5-carboxamide?
The CAS number of 6-bromo-N-phenyl-1,3-benzodioxole-5-carboxamide is 339267-17-3.
What is the molecular formula of 6-bromo-N-phenyl-1,3-benzodioxole-5-carboxamide?
The molecular formula of 6-bromo-N-phenyl-1,3-benzodioxole-5-carboxamide is C14H10BrNO3.
What is the molecular weight of 6-bromo-N-phenyl-1,3-benzodioxole-5-carboxamide?
The molecular weight of 6-bromo-N-phenyl-1,3-benzodioxole-5-carboxamide is 318.98 g/mol.
Where can I buy 6-bromo-N-phenyl-1,3-benzodioxole-5-carboxamide?
You can request a quote for 6-bromo-N-phenyl-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 6-bromo-N-phenyl-1,3-benzodioxole-5-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 6-bromo-N-phenyl-1,3-benzodioxole-5-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.