N-(1,3-benzodioxol-5-ylmethyl)-2,4-dichlorobenzamide
TL;DR: N-(1,3-benzodioxol-5-ylmethyl)-2,4-dichlorobenzamide (CAS 329919-52-0) is a chemical compound with molecular formula C15H11Cl2NO3 and molecular weight 323.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzodioxol-5-ylmethyl)-2,4-dichlorobenzamide
Also Known As: N-(1,3-benzodioxol-5-ylmethyl)-2,4-dichlorobenzamide, N-(2H-benzo[3,4-d]1,3-dioxolan-5-ylmethyl)(2,4-dichlorophenyl)carboxamide
| Molecular Formula | C15H11Cl2NO3 |
|---|---|
| Molecular Weight | 323.01 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 47.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 323.0116 |
| Heavy Atoms | 21 |
| Complexity | 382.0 |
Chemical Identifiers
| CAS Number | 329919-52-0 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=C(C=C(C=C3)Cl)Cl |
| InChIKey | PMVIDEWYBHLYMO-UHFFFAOYSA-N |
Product Overview
N-(1,3-benzodioxol-5-ylmethyl)-2,4-dichlorobenzamide (CAS 329919-52-0), with molecular formula C15H11Cl2NO3 and molecular weight 323.01 g/mol. IUPAC: N-(1,3-benzodioxol-5-ylmethyl)-2,4-dichlorobenzamide.
Chemical Property Profile of N-(1,3-benzodioxol-5-ylmethyl)-2,4-dichlorobenzamide
Property Insights of N-(1,3-benzodioxol-5-ylmethyl)-2,4-dichlorobenzamide
The XLogP value of 3.8 indicates that N-(1,3-benzodioxol-5-ylmethyl)-2,4-dichlorobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.6 Ų, N-(1,3-benzodioxol-5-ylmethyl)-2,4-dichlorobenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(1,3-benzodioxol-5-ylmethyl)-2,4-dichlorobenzamide 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)-2,4-dichlorobenzamide?
The CAS number of N-(1,3-benzodioxol-5-ylmethyl)-2,4-dichlorobenzamide is 329919-52-0.
What is the molecular formula of N-(1,3-benzodioxol-5-ylmethyl)-2,4-dichlorobenzamide?
The molecular formula of N-(1,3-benzodioxol-5-ylmethyl)-2,4-dichlorobenzamide is C15H11Cl2NO3.
What is the molecular weight of N-(1,3-benzodioxol-5-ylmethyl)-2,4-dichlorobenzamide?
The molecular weight of N-(1,3-benzodioxol-5-ylmethyl)-2,4-dichlorobenzamide is 323.01 g/mol.
Where can I buy N-(1,3-benzodioxol-5-ylmethyl)-2,4-dichlorobenzamide?
You can request a quote for N-(1,3-benzodioxol-5-ylmethyl)-2,4-dichlorobenzamide 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)-2,4-dichlorobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,3-benzodioxol-5-ylmethyl)-2,4-dichlorobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.