n-(2,3-Dihydro-1,4-benzodioxin-6-yl)-4-nitrobenzamide
TL;DR: n-(2,3-Dihydro-1,4-benzodioxin-6-yl)-4-nitrobenzamide (CAS 5722-11-2) is a chemical compound with molecular formula C15H12N2O5 and molecular weight 300.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-nitrobenzamide
Also Known As: n-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-nitrobenzamide, BIM-0027826.P001, AE-848/09344020, N-(2H,3H-benzo[3,4-e]1,4-dioxan-6-yl)(4-nitrophenyl)carboxamide
| Molecular Formula | C15H12N2O5 |
|---|---|
| Molecular Weight | 300.07 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 93.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 300.07462 |
| Heavy Atoms | 22 |
| Complexity | 417.0 |
Chemical Identifiers
| CAS Number | 5722-11-2 |
|---|---|
| SMILES | C1COC2=C(O1)C=CC(=C2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-] |
| InChIKey | FMDJDYPHUALRGG-UHFFFAOYSA-N |
Product Overview
n-(2,3-Dihydro-1,4-benzodioxin-6-yl)-4-nitrobenzamide (CAS 5722-11-2), with molecular formula C15H12N2O5 and molecular weight 300.07 g/mol. IUPAC: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-nitrobenzamide.
Chemical Property Profile of n-(2,3-Dihydro-1,4-benzodioxin-6-yl)-4-nitrobenzamide
Property Insights of n-(2,3-Dihydro-1,4-benzodioxin-6-yl)-4-nitrobenzamide
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for n-(2,3-Dihydro-1,4-benzodioxin-6-yl)-4-nitrobenzamide. The TPSA of 93.4 Ų falls within the moderate polarity range, balancing permeability and solubility for n-(2,3-Dihydro-1,4-benzodioxin-6-yl)-4-nitrobenzamide. Following Lipinski's Rule of Five, n-(2,3-Dihydro-1,4-benzodioxin-6-yl)-4-nitrobenzamide 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-(2,3-Dihydro-1,4-benzodioxin-6-yl)-4-nitrobenzamide?
The CAS number of n-(2,3-Dihydro-1,4-benzodioxin-6-yl)-4-nitrobenzamide is 5722-11-2.
What is the molecular formula of n-(2,3-Dihydro-1,4-benzodioxin-6-yl)-4-nitrobenzamide?
The molecular formula of n-(2,3-Dihydro-1,4-benzodioxin-6-yl)-4-nitrobenzamide is C15H12N2O5.
What is the molecular weight of n-(2,3-Dihydro-1,4-benzodioxin-6-yl)-4-nitrobenzamide?
The molecular weight of n-(2,3-Dihydro-1,4-benzodioxin-6-yl)-4-nitrobenzamide is 300.07 g/mol.
Where can I buy n-(2,3-Dihydro-1,4-benzodioxin-6-yl)-4-nitrobenzamide?
You can request a quote for n-(2,3-Dihydro-1,4-benzodioxin-6-yl)-4-nitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for n-(2,3-Dihydro-1,4-benzodioxin-6-yl)-4-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for n-(2,3-Dihydro-1,4-benzodioxin-6-yl)-4-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.