N-(3-chloro-4-cyanophenyl)-1,3-benzodioxole-5-carboxamide
TL;DR: N-(3-chloro-4-cyanophenyl)-1,3-benzodioxole-5-carboxamide (CAS 349132-66-7) is a chemical compound with molecular formula C15H9ClN2O3 and molecular weight 300.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-chloro-4-cyanophenyl)-1,3-benzodioxole-5-carboxamide
Also Known As: N-(3-chloro-4-cyanophenyl)-1,3-benzodioxole-5-carboxamide
| Molecular Formula | C15H9ClN2O3 |
|---|---|
| Molecular Weight | 300.03 g/mol |
| LogP | 3.19268 |
| Topological Polar Surface Area | 71.35 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 300.03018 |
| Heavy Atoms | 21 |
| Complexity | 767.99945 |
Chemical Identifiers
| CAS Number | 349132-66-7 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)C(=O)NC3=CC(=C(C=C3)C#N)Cl |
Product Overview
N-(3-chloro-4-cyanophenyl)-1,3-benzodioxole-5-carboxamide (CAS 349132-66-7), with molecular formula C15H9ClN2O3 and molecular weight 300.03 g/mol. IUPAC: N-(3-chloro-4-cyanophenyl)-1,3-benzodioxole-5-carboxamide.
Chemical Property Profile of N-(3-chloro-4-cyanophenyl)-1,3-benzodioxole-5-carboxamide
Property Insights of N-(3-chloro-4-cyanophenyl)-1,3-benzodioxole-5-carboxamide
The XLogP value of 3.19268 indicates that N-(3-chloro-4-cyanophenyl)-1,3-benzodioxole-5-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.35 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3-chloro-4-cyanophenyl)-1,3-benzodioxole-5-carboxamide. Following Lipinski's Rule of Five, N-(3-chloro-4-cyanophenyl)-1,3-benzodioxole-5-carboxamide 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-(3-chloro-4-cyanophenyl)-1,3-benzodioxole-5-carboxamide?
The CAS number of N-(3-chloro-4-cyanophenyl)-1,3-benzodioxole-5-carboxamide is 349132-66-7.
What is the molecular formula of N-(3-chloro-4-cyanophenyl)-1,3-benzodioxole-5-carboxamide?
The molecular formula of N-(3-chloro-4-cyanophenyl)-1,3-benzodioxole-5-carboxamide is C15H9ClN2O3.
What is the molecular weight of N-(3-chloro-4-cyanophenyl)-1,3-benzodioxole-5-carboxamide?
The molecular weight of N-(3-chloro-4-cyanophenyl)-1,3-benzodioxole-5-carboxamide is 300.03 g/mol.
Where can I buy N-(3-chloro-4-cyanophenyl)-1,3-benzodioxole-5-carboxamide?
You can request a quote for N-(3-chloro-4-cyanophenyl)-1,3-benzodioxole-5-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-chloro-4-cyanophenyl)-1,3-benzodioxole-5-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3-chloro-4-cyanophenyl)-1,3-benzodioxole-5-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.