2,1,3-Benzoxadiazole-4,5-diamine
TL;DR: 2,1,3-Benzoxadiazole-4,5-diamine (CAS 70015-83-7) is a chemical compound with molecular formula C6H6N4O and molecular weight 150.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,1,3-benzoxadiazole-4,5-diamine
Also Known As: 2,1,3-Benzoxadiazole-4,5-diamine, 4,5-Diaminobenzofurazan, Maybridge1_004387, benzofurazan-4,5-diamine, Benzo[c][1,2,5]oxadiazole-4,5-diamine
| Molecular Formula | C6H6N4O |
|---|---|
| Molecular Weight | 150.05 g/mol |
| LogP | -0.2 |
| Topological Polar Surface Area | 91.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 150.05415 |
| Heavy Atoms | 11 |
| Complexity | 154.0 |
Chemical Identifiers
| CAS Number | 70015-83-7 |
|---|---|
| SMILES | C1=CC2=NON=C2C(=C1N)N |
| InChIKey | SHWDQDBUVFATHY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,1,3-Benzoxadiazole-4,5-diamine (CAS 70015-83-7), with molecular formula C6H6N4O and molecular weight 150.05 g/mol. IUPAC: 2,1,3-benzoxadiazole-4,5-diamine.
Chemical Property Profile of 2,1,3-Benzoxadiazole-4,5-diamine
Property Insights of 2,1,3-Benzoxadiazole-4,5-diamine
The XLogP value of -0.2 indicates that 2,1,3-Benzoxadiazole-4,5-diamine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 91.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,1,3-Benzoxadiazole-4,5-diamine. Following Lipinski's Rule of Five, 2,1,3-Benzoxadiazole-4,5-diamine has 2 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 2,1,3-Benzoxadiazole-4,5-diamine?
The CAS number of 2,1,3-Benzoxadiazole-4,5-diamine is 70015-83-7.
What is the molecular formula of 2,1,3-Benzoxadiazole-4,5-diamine?
The molecular formula of 2,1,3-Benzoxadiazole-4,5-diamine is C6H6N4O.
What is the molecular weight of 2,1,3-Benzoxadiazole-4,5-diamine?
The molecular weight of 2,1,3-Benzoxadiazole-4,5-diamine is 150.05 g/mol.
Where can I buy 2,1,3-Benzoxadiazole-4,5-diamine?
You can request a quote for 2,1,3-Benzoxadiazole-4,5-diamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,1,3-Benzoxadiazole-4,5-diamine?
Yes, KEHONG BIO provides custom synthesis services for 2,1,3-Benzoxadiazole-4,5-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.