N-(2-methoxy-5-nitrophenyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide
TL;DR: N-(2-methoxy-5-nitrophenyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide (CAS 449168-04-1) is a chemical compound with molecular formula C16H14N2O6 and molecular weight 330.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-methoxy-5-nitrophenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide
Also Known As: 2H,3H-benzo[e]1,4-dioxan-2-yl-N-(2-methoxy-5-nitrophenyl)carboxamide, N-(2-methoxy-5-nitrophenyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide, N-(2-methoxy-5-nitrophenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide, N-(2-methoxy-5-nitrophenyl)-2,3-dihydrobenzo[b][1,4]dioxine-2-carboxamide
| Molecular Formula | C16H14N2O6 |
|---|---|
| Molecular Weight | 330.09 g/mol |
| LogP | 2.3819 |
| Topological Polar Surface Area | 99.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 330.08517 |
| Heavy Atoms | 24 |
| Complexity | 791.88715 |
Chemical Identifiers
| CAS Number | 449168-04-1 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C2COC3=CC=CC=C3O2 |
Product Overview
N-(2-methoxy-5-nitrophenyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide (CAS 449168-04-1), with molecular formula C16H14N2O6 and molecular weight 330.09 g/mol. IUPAC: N-(2-methoxy-5-nitrophenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide.
Chemical Property Profile of N-(2-methoxy-5-nitrophenyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide
Property Insights of N-(2-methoxy-5-nitrophenyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide
The XLogP value of 2.3819 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-methoxy-5-nitrophenyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide. The TPSA of 99.93 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2-methoxy-5-nitrophenyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide. Following Lipinski's Rule of Five, N-(2-methoxy-5-nitrophenyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide has 1 hydrogen bond donor(s) and 6 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-methoxy-5-nitrophenyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide?
The CAS number of N-(2-methoxy-5-nitrophenyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide is 449168-04-1.
What is the molecular formula of N-(2-methoxy-5-nitrophenyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide?
The molecular formula of N-(2-methoxy-5-nitrophenyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide is C16H14N2O6.
What is the molecular weight of N-(2-methoxy-5-nitrophenyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide?
The molecular weight of N-(2-methoxy-5-nitrophenyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide is 330.09 g/mol.
Where can I buy N-(2-methoxy-5-nitrophenyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide?
You can request a quote for N-(2-methoxy-5-nitrophenyl)-2,3-dihydro-1,4-benzodioxine-2-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-methoxy-5-nitrophenyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2-methoxy-5-nitrophenyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.