N-(1,3-benzodioxol-5-ylmethyl)-4-methylbenzamide
TL;DR: N-(1,3-benzodioxol-5-ylmethyl)-4-methylbenzamide (CAS 349613-64-5) 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-ylmethyl)-4-methylbenzamide
Also Known As: N-(1,3-benzodioxol-5-ylmethyl)-4-methylbenzamide, N-[(1,3-Benzodioxol-5-yl)methyl]-4-methylbenzamide, N-(2H-1,3-BENZODIOXOL-5-YLMETHYL)-4-METHYLBENZAMIDE, N-(2H-benzo[3,4-d]1,3-dioxolan-5-ylmethyl)(4-methylphenyl)carboxamide, Cambridge id 5859181
| Molecular Formula | C16H15NO3 |
|---|---|
| Molecular Weight | 269.11 g/mol |
| LogP | 2.65372 |
| Topological Polar Surface Area | 47.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 269.1052 |
| Heavy Atoms | 20 |
| Complexity | 634.6703 |
Chemical Identifiers
| CAS Number | 349613-64-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)NCC2=CC3=C(C=C2)OCO3 |
Product Overview
N-(1,3-benzodioxol-5-ylmethyl)-4-methylbenzamide (CAS 349613-64-5), with molecular formula C16H15NO3 and molecular weight 269.11 g/mol. IUPAC: N-(1,3-benzodioxol-5-ylmethyl)-4-methylbenzamide.
Chemical Property Profile of N-(1,3-benzodioxol-5-ylmethyl)-4-methylbenzamide
Property Insights of N-(1,3-benzodioxol-5-ylmethyl)-4-methylbenzamide
The XLogP value of 2.65372 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(1,3-benzodioxol-5-ylmethyl)-4-methylbenzamide. With a topological polar surface area (TPSA) of 47.56 Ų, N-(1,3-benzodioxol-5-ylmethyl)-4-methylbenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(1,3-benzodioxol-5-ylmethyl)-4-methylbenzamide 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-ylmethyl)-4-methylbenzamide?
The CAS number of N-(1,3-benzodioxol-5-ylmethyl)-4-methylbenzamide is 349613-64-5.
What is the molecular formula of N-(1,3-benzodioxol-5-ylmethyl)-4-methylbenzamide?
The molecular formula of N-(1,3-benzodioxol-5-ylmethyl)-4-methylbenzamide is C16H15NO3.
What is the molecular weight of N-(1,3-benzodioxol-5-ylmethyl)-4-methylbenzamide?
The molecular weight of N-(1,3-benzodioxol-5-ylmethyl)-4-methylbenzamide is 269.11 g/mol.
Where can I buy N-(1,3-benzodioxol-5-ylmethyl)-4-methylbenzamide?
You can request a quote for N-(1,3-benzodioxol-5-ylmethyl)-4-methylbenzamide 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-ylmethyl)-4-methylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,3-benzodioxol-5-ylmethyl)-4-methylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.