N-(1,3-benzodioxol-5-yl)-2-methoxy-4-(trifluoromethyl)benzamide
TL;DR: N-(1,3-benzodioxol-5-yl)-2-methoxy-4-(trifluoromethyl)benzamide (CAS 893763-79-6) is a chemical compound with molecular formula C16H12F3NO4 and molecular weight 339.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzodioxol-5-yl)-2-methoxy-4-(trifluoromethyl)benzamide
Also Known As: N-(1,3-benzodioxol-5-yl)-2-methoxy-4-(trifluoromethyl)benzamide, A4080/0173901, N-1,3-benzodioxol-5-yl-2-methoxy-4-(trifluoromethyl)benzamide, Benzamide, N-(1,3-benzodioxol-5-yl)-2-methoxy-4-(trifluoromethyl)-, N-(2H-1,3-BENZODIOXOL-5-YL)-2-METHOXY-4-(TRIFLUOROMETHYL)BENZAMIDE
| Molecular Formula | C16H12F3NO4 |
|---|---|
| Molecular Weight | 339.07 g/mol |
| LogP | 3.695 |
| Topological Polar Surface Area | 56.79 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 339.07184 |
| Heavy Atoms | 24 |
| Complexity | 789.3774 |
Chemical Identifiers
| CAS Number | 893763-79-6 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)C(F)(F)F)C(=O)NC2=CC3=C(C=C2)OCO3 |
Product Overview
N-(1,3-benzodioxol-5-yl)-2-methoxy-4-(trifluoromethyl)benzamide (CAS 893763-79-6), with molecular formula C16H12F3NO4 and molecular weight 339.07 g/mol. IUPAC: N-(1,3-benzodioxol-5-yl)-2-methoxy-4-(trifluoromethyl)benzamide.
Chemical Property Profile of N-(1,3-benzodioxol-5-yl)-2-methoxy-4-(trifluoromethyl)benzamide
Property Insights of N-(1,3-benzodioxol-5-yl)-2-methoxy-4-(trifluoromethyl)benzamide
The XLogP value of 3.695 indicates that N-(1,3-benzodioxol-5-yl)-2-methoxy-4-(trifluoromethyl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.79 Ų, N-(1,3-benzodioxol-5-yl)-2-methoxy-4-(trifluoromethyl)benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(1,3-benzodioxol-5-yl)-2-methoxy-4-(trifluoromethyl)benzamide 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-(1,3-benzodioxol-5-yl)-2-methoxy-4-(trifluoromethyl)benzamide?
The CAS number of N-(1,3-benzodioxol-5-yl)-2-methoxy-4-(trifluoromethyl)benzamide is 893763-79-6.
What is the molecular formula of N-(1,3-benzodioxol-5-yl)-2-methoxy-4-(trifluoromethyl)benzamide?
The molecular formula of N-(1,3-benzodioxol-5-yl)-2-methoxy-4-(trifluoromethyl)benzamide is C16H12F3NO4.
What is the molecular weight of N-(1,3-benzodioxol-5-yl)-2-methoxy-4-(trifluoromethyl)benzamide?
The molecular weight of N-(1,3-benzodioxol-5-yl)-2-methoxy-4-(trifluoromethyl)benzamide is 339.07 g/mol.
Where can I buy N-(1,3-benzodioxol-5-yl)-2-methoxy-4-(trifluoromethyl)benzamide?
You can request a quote for N-(1,3-benzodioxol-5-yl)-2-methoxy-4-(trifluoromethyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1,3-benzodioxol-5-yl)-2-methoxy-4-(trifluoromethyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,3-benzodioxol-5-yl)-2-methoxy-4-(trifluoromethyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.