N-(1,3-benzodioxol-5-ylmethyl)-4-chlorobenzamide
TL;DR: N-(1,3-benzodioxol-5-ylmethyl)-4-chlorobenzamide (CAS 312284-90-5) is a chemical compound with molecular formula C15H12ClNO3 and molecular weight 289.05 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-chlorobenzamide
Also Known As: TimTec1_000562, N-(1,3-benzodioxol-5-ylmethyl)-4-chlorobenzamide, BAS 00804406, UPCMLD0ENAT5898598:001, N-Benzo[1,3]dioxol-5-ylmethyl-4-chloro-benzamide
| Molecular Formula | C15H12ClNO3 |
|---|---|
| Molecular Weight | 289.05 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 47.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 289.05057 |
| Heavy Atoms | 20 |
| Complexity | 344.0 |
Chemical Identifiers
| CAS Number | 312284-90-5 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=CC=C(C=C3)Cl |
| InChIKey | FQUQPHMPMAOXCY-UHFFFAOYSA-N |
Product Overview
N-(1,3-benzodioxol-5-ylmethyl)-4-chlorobenzamide (CAS 312284-90-5), with molecular formula C15H12ClNO3 and molecular weight 289.05 g/mol. IUPAC: N-(1,3-benzodioxol-5-ylmethyl)-4-chlorobenzamide.
Chemical Property Profile of N-(1,3-benzodioxol-5-ylmethyl)-4-chlorobenzamide
Property Insights of N-(1,3-benzodioxol-5-ylmethyl)-4-chlorobenzamide
The XLogP value of 3.3 indicates that N-(1,3-benzodioxol-5-ylmethyl)-4-chlorobenzamide 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)-4-chlorobenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(1,3-benzodioxol-5-ylmethyl)-4-chlorobenzamide 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-chlorobenzamide?
The CAS number of N-(1,3-benzodioxol-5-ylmethyl)-4-chlorobenzamide is 312284-90-5.
What is the molecular formula of N-(1,3-benzodioxol-5-ylmethyl)-4-chlorobenzamide?
The molecular formula of N-(1,3-benzodioxol-5-ylmethyl)-4-chlorobenzamide is C15H12ClNO3.
What is the molecular weight of N-(1,3-benzodioxol-5-ylmethyl)-4-chlorobenzamide?
The molecular weight of N-(1,3-benzodioxol-5-ylmethyl)-4-chlorobenzamide is 289.05 g/mol.
Where can I buy N-(1,3-benzodioxol-5-ylmethyl)-4-chlorobenzamide?
You can request a quote for N-(1,3-benzodioxol-5-ylmethyl)-4-chlorobenzamide 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-chlorobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,3-benzodioxol-5-ylmethyl)-4-chlorobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.