N-phenyl-1,3-benzodioxole-5-carboxamide
TL;DR: N-phenyl-1,3-benzodioxole-5-carboxamide (CAS 40141-72-8) is a chemical compound with molecular formula C14H11NO3 and molecular weight 241.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-phenyl-1,3-benzodioxole-5-carboxamide
Also Known As: N-Phenylpiperonylamid, N-phenyl-1,3-benzodioxole-5-carboxamide, N-phenyl-2H-1,3-benzodioxole-5-carboxamide, N-phenyl-3,4-methylenedioxybenzamide, N-phenylbenzo[d][1,3]dioxole-5-carboxamide
| Molecular Formula | C14H11NO3 |
|---|---|
| Molecular Weight | 241.07 g/mol |
| LogP | 2.6676 |
| Topological Polar Surface Area | 47.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 241.0739 |
| Heavy Atoms | 18 |
| Complexity | 580.8479 |
Chemical Identifiers
| CAS Number | 40141-72-8 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)C(=O)NC3=CC=CC=C3 |
Product Overview
N-phenyl-1,3-benzodioxole-5-carboxamide (CAS 40141-72-8), with molecular formula C14H11NO3 and molecular weight 241.07 g/mol. IUPAC: N-phenyl-1,3-benzodioxole-5-carboxamide.
Chemical Property Profile of N-phenyl-1,3-benzodioxole-5-carboxamide
Property Insights of N-phenyl-1,3-benzodioxole-5-carboxamide
The XLogP value of 2.6676 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-phenyl-1,3-benzodioxole-5-carboxamide. With a topological polar surface area (TPSA) of 47.56 Ų, N-phenyl-1,3-benzodioxole-5-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 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 N-phenyl-1,3-benzodioxole-5-carboxamide?
The CAS number of N-phenyl-1,3-benzodioxole-5-carboxamide is 40141-72-8.
What is the molecular formula of N-phenyl-1,3-benzodioxole-5-carboxamide?
The molecular formula of N-phenyl-1,3-benzodioxole-5-carboxamide is C14H11NO3.
What is the molecular weight of N-phenyl-1,3-benzodioxole-5-carboxamide?
The molecular weight of N-phenyl-1,3-benzodioxole-5-carboxamide is 241.07 g/mol.
Where can I buy N-phenyl-1,3-benzodioxole-5-carboxamide?
You can request a quote for 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 N-phenyl-1,3-benzodioxole-5-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-phenyl-1,3-benzodioxole-5-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.