N-(1,3-benzodioxol-5-ylmethyl)-2-methoxy-3-methylbenzamide
TL;DR: N-(1,3-benzodioxol-5-ylmethyl)-2-methoxy-3-methylbenzamide (CAS 311324-06-8) is a chemical compound with molecular formula C17H17NO4 and molecular weight 299.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzodioxol-5-ylmethyl)-2-methoxy-3-methylbenzamide
Also Known As: N-(1,3-benzodioxol-5-ylmethyl)-2-methoxy-3-methylbenzamide, A1271/0058122, N-[(2H-1,3-BENZODIOXOL-5-YL)METHYL]-2-METHOXY-3-METHYLBENZAMIDE, N-(2H-benzo[3,4-d]1,3-dioxolan-5-ylmethyl)(2-methoxy-3-methylphenyl)carboxamid e
| Molecular Formula | C17H17NO4 |
|---|---|
| Molecular Weight | 299.12 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 56.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 299.11575 |
| Heavy Atoms | 22 |
| Complexity | 389.0 |
Chemical Identifiers
| CAS Number | 311324-06-8 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)C(=O)NCC2=CC3=C(C=C2)OCO3)OC |
| InChIKey | HDEFMCYJYKKYRS-UHFFFAOYSA-N |
Product Overview
N-(1,3-benzodioxol-5-ylmethyl)-2-methoxy-3-methylbenzamide (CAS 311324-06-8), with molecular formula C17H17NO4 and molecular weight 299.12 g/mol. IUPAC: N-(1,3-benzodioxol-5-ylmethyl)-2-methoxy-3-methylbenzamide.
Chemical Property Profile of N-(1,3-benzodioxol-5-ylmethyl)-2-methoxy-3-methylbenzamide
Property Insights of N-(1,3-benzodioxol-5-ylmethyl)-2-methoxy-3-methylbenzamide
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(1,3-benzodioxol-5-ylmethyl)-2-methoxy-3-methylbenzamide. With a topological polar surface area (TPSA) of 56.8 Ų, N-(1,3-benzodioxol-5-ylmethyl)-2-methoxy-3-methylbenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(1,3-benzodioxol-5-ylmethyl)-2-methoxy-3-methylbenzamide 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-ylmethyl)-2-methoxy-3-methylbenzamide?
The CAS number of N-(1,3-benzodioxol-5-ylmethyl)-2-methoxy-3-methylbenzamide is 311324-06-8.
What is the molecular formula of N-(1,3-benzodioxol-5-ylmethyl)-2-methoxy-3-methylbenzamide?
The molecular formula of N-(1,3-benzodioxol-5-ylmethyl)-2-methoxy-3-methylbenzamide is C17H17NO4.
What is the molecular weight of N-(1,3-benzodioxol-5-ylmethyl)-2-methoxy-3-methylbenzamide?
The molecular weight of N-(1,3-benzodioxol-5-ylmethyl)-2-methoxy-3-methylbenzamide is 299.12 g/mol.
Where can I buy N-(1,3-benzodioxol-5-ylmethyl)-2-methoxy-3-methylbenzamide?
You can request a quote for N-(1,3-benzodioxol-5-ylmethyl)-2-methoxy-3-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)-2-methoxy-3-methylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,3-benzodioxol-5-ylmethyl)-2-methoxy-3-methylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.