N-(2-methyl-1,3-dioxoisoindol-5-yl)-1,3-benzodioxole-5-carboxamide
TL;DR: N-(2-methyl-1,3-dioxoisoindol-5-yl)-1,3-benzodioxole-5-carboxamide (CAS 701951-55-5) is a chemical compound with molecular formula C17H12N2O5 and molecular weight 324.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-methyl-1,3-dioxoisoindol-5-yl)-1,3-benzodioxole-5-carboxamide
Also Known As: N-(2-methyl-1,3-dioxoisoindol-5-yl)-1,3-benzodioxole-5-carboxamide, N-(2-methyl-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl)-1,3-benzodioxole-5-carboxamide
| Molecular Formula | C17H12N2O5 |
|---|---|
| Molecular Weight | 324.07 g/mol |
| LogP | 1.8934 |
| Topological Polar Surface Area | 84.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 324.07462 |
| Heavy Atoms | 24 |
| Complexity | 905.84906 |
Chemical Identifiers
| CAS Number | 701951-55-5 |
|---|---|
| SMILES | CN1C(=O)C2=C(C1=O)C=C(C=C2)NC(=O)C3=CC4=C(C=C3)OCO4 |
Product Overview
N-(2-methyl-1,3-dioxoisoindol-5-yl)-1,3-benzodioxole-5-carboxamide (CAS 701951-55-5), with molecular formula C17H12N2O5 and molecular weight 324.07 g/mol. IUPAC: N-(2-methyl-1,3-dioxoisoindol-5-yl)-1,3-benzodioxole-5-carboxamide.
Chemical Property Profile of N-(2-methyl-1,3-dioxoisoindol-5-yl)-1,3-benzodioxole-5-carboxamide
Property Insights of N-(2-methyl-1,3-dioxoisoindol-5-yl)-1,3-benzodioxole-5-carboxamide
The XLogP value of 1.8934 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-methyl-1,3-dioxoisoindol-5-yl)-1,3-benzodioxole-5-carboxamide. The TPSA of 84.94 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2-methyl-1,3-dioxoisoindol-5-yl)-1,3-benzodioxole-5-carboxamide. Following Lipinski's Rule of Five, N-(2-methyl-1,3-dioxoisoindol-5-yl)-1,3-benzodioxole-5-carboxamide has 1 hydrogen bond donor(s) and 5 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-(2-methyl-1,3-dioxoisoindol-5-yl)-1,3-benzodioxole-5-carboxamide?
The CAS number of N-(2-methyl-1,3-dioxoisoindol-5-yl)-1,3-benzodioxole-5-carboxamide is 701951-55-5.
What is the molecular formula of N-(2-methyl-1,3-dioxoisoindol-5-yl)-1,3-benzodioxole-5-carboxamide?
The molecular formula of N-(2-methyl-1,3-dioxoisoindol-5-yl)-1,3-benzodioxole-5-carboxamide is C17H12N2O5.
What is the molecular weight of N-(2-methyl-1,3-dioxoisoindol-5-yl)-1,3-benzodioxole-5-carboxamide?
The molecular weight of N-(2-methyl-1,3-dioxoisoindol-5-yl)-1,3-benzodioxole-5-carboxamide is 324.07 g/mol.
Where can I buy N-(2-methyl-1,3-dioxoisoindol-5-yl)-1,3-benzodioxole-5-carboxamide?
You can request a quote for N-(2-methyl-1,3-dioxoisoindol-5-yl)-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-(2-methyl-1,3-dioxoisoindol-5-yl)-1,3-benzodioxole-5-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2-methyl-1,3-dioxoisoindol-5-yl)-1,3-benzodioxole-5-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.