2-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-nitrobenzamide
TL;DR: 2-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-nitrobenzamide (CAS 289494-20-8) is a chemical compound with molecular formula C15H11ClN2O5 and molecular weight 334.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-nitrobenzamide
Also Known As: 2-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-nitrobenzamide, 2-chloro-N-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-4-nitrobenzamide, N-(2H,3H-benzo[3,4-e]1,4-dioxan-6-yl)(2-chloro-4-nitrophenyl)carboxamide
| Molecular Formula | C15H11ClN2O5 |
|---|---|
| Molecular Weight | 334.04 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 93.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 334.03564 |
| Heavy Atoms | 23 |
| Complexity | 458.0 |
Chemical Identifiers
| CAS Number | 289494-20-8 |
|---|---|
| SMILES | C1COC2=C(O1)C=CC(=C2)NC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl |
| InChIKey | REUJBTZDGJRMSY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-nitrobenzamide (CAS 289494-20-8), with molecular formula C15H11ClN2O5 and molecular weight 334.04 g/mol. IUPAC: 2-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-nitrobenzamide.
Chemical Property Profile of 2-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-nitrobenzamide
Property Insights of 2-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-nitrobenzamide
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-chloro-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 2-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-nitrobenzamide. Following Lipinski's Rule of Five, 2-chloro-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 2-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-nitrobenzamide?
The CAS number of 2-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-nitrobenzamide is 289494-20-8.
What is the molecular formula of 2-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-nitrobenzamide?
The molecular formula of 2-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-nitrobenzamide is C15H11ClN2O5.
What is the molecular weight of 2-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-nitrobenzamide?
The molecular weight of 2-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-nitrobenzamide is 334.04 g/mol.
Where can I buy 2-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-nitrobenzamide?
You can request a quote for 2-chloro-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 2-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for 2-chloro-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.