7-Nitro-2,1,3-benzoxadiazole-4,6-diamine
TL;DR: 7-Nitro-2,1,3-benzoxadiazole-4,6-diamine (CAS 376624-84-9) is a chemical compound with molecular formula C6H5N5O3 and molecular weight 195.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-nitro-2,1,3-benzoxadiazole-5,7-diamine
Also Known As: ChemDiv1_017508, 4-nitro-2,1,3-benzoxadiazole-5,7-diamine, 7-nitro-2,1,3-benzoxadiazole-4,6-diamine, 7-Nitro-benzo[1,2,5]oxadiazole-4,6-diamine, 7-nitrobenzo[c][1,2,5]oxadiazole-4,6-diamine
| Molecular Formula | C6H5N5O3 |
|---|---|
| Molecular Weight | 195.04 g/mol |
| LogP | 0.2954 |
| Topological Polar Surface Area | 134.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 1 |
| Exact Mass | 195.03925 |
| Heavy Atoms | 14 |
| Complexity | 519.4065 |
Chemical Identifiers
| CAS Number | 376624-84-9 |
|---|---|
| SMILES | C1=C(C2=NON=C2C(=C1N)[N+](=O)[O-])N |
Product Overview
7-Nitro-2,1,3-benzoxadiazole-4,6-diamine (CAS 376624-84-9), with molecular formula C6H5N5O3 and molecular weight 195.04 g/mol. IUPAC: 4-nitro-2,1,3-benzoxadiazole-5,7-diamine.
Chemical Property Profile of 7-Nitro-2,1,3-benzoxadiazole-4,6-diamine
Property Insights of 7-Nitro-2,1,3-benzoxadiazole-4,6-diamine
The XLogP value of 0.2954 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-Nitro-2,1,3-benzoxadiazole-4,6-diamine. The TPSA of 134.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-Nitro-2,1,3-benzoxadiazole-4,6-diamine. Following Lipinski's Rule of Five, 7-Nitro-2,1,3-benzoxadiazole-4,6-diamine has 2 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 7-Nitro-2,1,3-benzoxadiazole-4,6-diamine?
The CAS number of 7-Nitro-2,1,3-benzoxadiazole-4,6-diamine is 376624-84-9.
What is the molecular formula of 7-Nitro-2,1,3-benzoxadiazole-4,6-diamine?
The molecular formula of 7-Nitro-2,1,3-benzoxadiazole-4,6-diamine is C6H5N5O3.
What is the molecular weight of 7-Nitro-2,1,3-benzoxadiazole-4,6-diamine?
The molecular weight of 7-Nitro-2,1,3-benzoxadiazole-4,6-diamine is 195.04 g/mol.
Where can I buy 7-Nitro-2,1,3-benzoxadiazole-4,6-diamine?
You can request a quote for 7-Nitro-2,1,3-benzoxadiazole-4,6-diamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-Nitro-2,1,3-benzoxadiazole-4,6-diamine?
Yes, KEHONG BIO provides custom synthesis services for 7-Nitro-2,1,3-benzoxadiazole-4,6-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.