N-(1,3-benzodioxol-5-yl)-3,5-dimethylbenzamide
TL;DR: N-(1,3-benzodioxol-5-yl)-3,5-dimethylbenzamide (CAS 847589-44-0) is a chemical compound with molecular formula C16H15NO3 and molecular weight 269.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzodioxol-5-yl)-3,5-dimethylbenzamide
Also Known As: N-(1,3-benzodioxol-5-yl)-3,5-dimethylbenzamide, AO-854/43444925
| Molecular Formula | C16H15NO3 |
|---|---|
| Molecular Weight | 269.11 g/mol |
| LogP | 3.28444 |
| Topological Polar Surface Area | 47.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 269.1052 |
| Heavy Atoms | 20 |
| Complexity | 659.16736 |
Chemical Identifiers
| CAS Number | 847589-44-0 |
|---|---|
| SMILES | CC1=CC(=CC(=C1)C(=O)NC2=CC3=C(C=C2)OCO3)C |
Product Overview
N-(1,3-benzodioxol-5-yl)-3,5-dimethylbenzamide (CAS 847589-44-0), with molecular formula C16H15NO3 and molecular weight 269.11 g/mol. IUPAC: N-(1,3-benzodioxol-5-yl)-3,5-dimethylbenzamide.
Chemical Property Profile of N-(1,3-benzodioxol-5-yl)-3,5-dimethylbenzamide
Property Insights of N-(1,3-benzodioxol-5-yl)-3,5-dimethylbenzamide
The XLogP value of 3.28444 indicates that N-(1,3-benzodioxol-5-yl)-3,5-dimethylbenzamide 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-(1,3-benzodioxol-5-yl)-3,5-dimethylbenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(1,3-benzodioxol-5-yl)-3,5-dimethylbenzamide 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-(1,3-benzodioxol-5-yl)-3,5-dimethylbenzamide?
The CAS number of N-(1,3-benzodioxol-5-yl)-3,5-dimethylbenzamide is 847589-44-0.
What is the molecular formula of N-(1,3-benzodioxol-5-yl)-3,5-dimethylbenzamide?
The molecular formula of N-(1,3-benzodioxol-5-yl)-3,5-dimethylbenzamide is C16H15NO3.
What is the molecular weight of N-(1,3-benzodioxol-5-yl)-3,5-dimethylbenzamide?
The molecular weight of N-(1,3-benzodioxol-5-yl)-3,5-dimethylbenzamide is 269.11 g/mol.
Where can I buy N-(1,3-benzodioxol-5-yl)-3,5-dimethylbenzamide?
You can request a quote for N-(1,3-benzodioxol-5-yl)-3,5-dimethylbenzamide 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)-3,5-dimethylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,3-benzodioxol-5-yl)-3,5-dimethylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.