N-(1,3-benzodioxol-5-yl)-3-chloro-4-methylbenzamide
TL;DR: N-(1,3-benzodioxol-5-yl)-3-chloro-4-methylbenzamide (CAS 432004-18-7) 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-yl)-3-chloro-4-methylbenzamide
Also Known As: N-(1,3-benzodioxol-5-yl)-3-chloro-4-methylbenzamide, N-(1,3-benzodioxol-5-yl)-3-chloro-4-methyl-benzamide, N-(1,3-benzodioxol-5-yl)-3-chloranyl-4-methyl-benzamide
| Molecular Formula | C15H12ClNO3 |
|---|---|
| Molecular Weight | 289.05 g/mol |
| LogP | 3.62942 |
| Topological Polar Surface Area | 47.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 289.05057 |
| Heavy Atoms | 20 |
| Complexity | 684.814 |
Chemical Identifiers
| CAS Number | 432004-18-7 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C(=O)NC2=CC3=C(C=C2)OCO3)Cl |
Product Overview
N-(1,3-benzodioxol-5-yl)-3-chloro-4-methylbenzamide (CAS 432004-18-7), with molecular formula C15H12ClNO3 and molecular weight 289.05 g/mol. IUPAC: N-(1,3-benzodioxol-5-yl)-3-chloro-4-methylbenzamide.
Chemical Property Profile of N-(1,3-benzodioxol-5-yl)-3-chloro-4-methylbenzamide
Property Insights of N-(1,3-benzodioxol-5-yl)-3-chloro-4-methylbenzamide
The XLogP value of 3.62942 indicates that N-(1,3-benzodioxol-5-yl)-3-chloro-4-methylbenzamide 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-chloro-4-methylbenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(1,3-benzodioxol-5-yl)-3-chloro-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-yl)-3-chloro-4-methylbenzamide?
The CAS number of N-(1,3-benzodioxol-5-yl)-3-chloro-4-methylbenzamide is 432004-18-7.
What is the molecular formula of N-(1,3-benzodioxol-5-yl)-3-chloro-4-methylbenzamide?
The molecular formula of N-(1,3-benzodioxol-5-yl)-3-chloro-4-methylbenzamide is C15H12ClNO3.
What is the molecular weight of N-(1,3-benzodioxol-5-yl)-3-chloro-4-methylbenzamide?
The molecular weight of N-(1,3-benzodioxol-5-yl)-3-chloro-4-methylbenzamide is 289.05 g/mol.
Where can I buy N-(1,3-benzodioxol-5-yl)-3-chloro-4-methylbenzamide?
You can request a quote for N-(1,3-benzodioxol-5-yl)-3-chloro-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-yl)-3-chloro-4-methylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,3-benzodioxol-5-yl)-3-chloro-4-methylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.