N-(2-ethoxyphenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine
TL;DR: N-(2-ethoxyphenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine (CAS 384355-85-5) is a chemical compound with molecular formula C14H12N4O4 and molecular weight 300.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-ethoxyphenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine
Also Known As: N-(2-ethoxyphenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine, N-(2-ethoxyphenyl)-4-nitrobenzo[c][1,2,5]oxadiazol-5-amine, REGID_for_CID_3409148
| Molecular Formula | C14H12N4O4 |
|---|---|
| Molecular Weight | 300.09 g/mol |
| LogP | 3.2733 |
| Topological Polar Surface Area | 103.32 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 300.08585 |
| Heavy Atoms | 22 |
| Complexity | 830.5758 |
Chemical Identifiers
| CAS Number | 384355-85-5 |
|---|---|
| SMILES | CCOC1=CC=CC=C1NC2=C(C3=NON=C3C=C2)[N+](=O)[O-] |
Product Overview
N-(2-ethoxyphenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine (CAS 384355-85-5), with molecular formula C14H12N4O4 and molecular weight 300.09 g/mol. IUPAC: N-(2-ethoxyphenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine.
Chemical Property Profile of N-(2-ethoxyphenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine
Property Insights of N-(2-ethoxyphenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine
The XLogP value of 3.2733 indicates that N-(2-ethoxyphenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 103.32 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2-ethoxyphenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine. Following Lipinski's Rule of Five, N-(2-ethoxyphenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine has 1 hydrogen bond donor(s) and 7 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-ethoxyphenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine?
The CAS number of N-(2-ethoxyphenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine is 384355-85-5.
What is the molecular formula of N-(2-ethoxyphenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine?
The molecular formula of N-(2-ethoxyphenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine is C14H12N4O4.
What is the molecular weight of N-(2-ethoxyphenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine?
The molecular weight of N-(2-ethoxyphenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine is 300.09 g/mol.
Where can I buy N-(2-ethoxyphenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine?
You can request a quote for N-(2-ethoxyphenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-ethoxyphenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine?
Yes, KEHONG BIO provides custom synthesis services for N-(2-ethoxyphenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.