N-(2-Methoxyphenyl)-7-nitro-2,1,3-benzoxadiazol-4-amine
TL;DR: N-(2-Methoxyphenyl)-7-nitro-2,1,3-benzoxadiazol-4-amine (CAS 5241-50-9) is a chemical compound with molecular formula C13H10N4O4 and molecular weight 286.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-methoxyphenyl)-4-nitro-2,1,3-benzoxadiazol-7-amine
Also Known As: BAS 01237236, N-(2-Methoxyphenyl)-7-nitro-2,1,3-benzoxadiazol-4-amine, N-(2-methoxyphenyl)-4-nitro-2,1,3-benzoxadiazol-7-amine, N-(2-METHOXYPHENYL)-2-NITRO-8-OXA-7,9-DIAZABICYCLO[4.3.0]NONA-2,4,6,9-TETRAEN-5-AMINE, (2-Methoxy-phenyl)-(7-nitro-benzo[1,2,5]oxadiazol-4-yl)-amine
| Molecular Formula | C13H10N4O4 |
|---|---|
| Molecular Weight | 286.07 g/mol |
| LogP | 2.8832 |
| Topological Polar Surface Area | 103.32 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 286.0702 |
| Heavy Atoms | 21 |
| Complexity | 814.7914 |
Chemical Identifiers
| CAS Number | 5241-50-9 |
|---|---|
| SMILES | COC1=CC=CC=C1NC2=CC=C(C3=NON=C23)[N+](=O)[O-] |
Product Overview
N-(2-Methoxyphenyl)-7-nitro-2,1,3-benzoxadiazol-4-amine (CAS 5241-50-9), with molecular formula C13H10N4O4 and molecular weight 286.07 g/mol. IUPAC: N-(2-methoxyphenyl)-4-nitro-2,1,3-benzoxadiazol-7-amine.
Chemical Property Profile of N-(2-Methoxyphenyl)-7-nitro-2,1,3-benzoxadiazol-4-amine
Property Insights of N-(2-Methoxyphenyl)-7-nitro-2,1,3-benzoxadiazol-4-amine
The XLogP value of 2.8832 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-Methoxyphenyl)-7-nitro-2,1,3-benzoxadiazol-4-amine. The TPSA of 103.32 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2-Methoxyphenyl)-7-nitro-2,1,3-benzoxadiazol-4-amine. Following Lipinski's Rule of Five, N-(2-Methoxyphenyl)-7-nitro-2,1,3-benzoxadiazol-4-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-Methoxyphenyl)-7-nitro-2,1,3-benzoxadiazol-4-amine?
The CAS number of N-(2-Methoxyphenyl)-7-nitro-2,1,3-benzoxadiazol-4-amine is 5241-50-9.
What is the molecular formula of N-(2-Methoxyphenyl)-7-nitro-2,1,3-benzoxadiazol-4-amine?
The molecular formula of N-(2-Methoxyphenyl)-7-nitro-2,1,3-benzoxadiazol-4-amine is C13H10N4O4.
What is the molecular weight of N-(2-Methoxyphenyl)-7-nitro-2,1,3-benzoxadiazol-4-amine?
The molecular weight of N-(2-Methoxyphenyl)-7-nitro-2,1,3-benzoxadiazol-4-amine is 286.07 g/mol.
Where can I buy N-(2-Methoxyphenyl)-7-nitro-2,1,3-benzoxadiazol-4-amine?
You can request a quote for N-(2-Methoxyphenyl)-7-nitro-2,1,3-benzoxadiazol-4-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-Methoxyphenyl)-7-nitro-2,1,3-benzoxadiazol-4-amine?
Yes, KEHONG BIO provides custom synthesis services for N-(2-Methoxyphenyl)-7-nitro-2,1,3-benzoxadiazol-4-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.