5-硝基-1,3-苯并噁唑-2-胺
TL;DR: 5-硝基-1,3-苯并噁唑-2-胺 (CAS 64037-16-7) is a chemical compound with molecular formula C7H5N3O3 and molecular weight 179.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-硝基-1,3-苯并噁唑-2-胺
5-nitro-1,3-benzoxazol-2-amine
Also Known As: 5-nitrobenzo[d]oxazol-2-amine, 5-nitro-1,3-benzoxazol-2-amine, 5-Nitrobenzoxazole-2-amine, 2-Amino-5-nitrobenzoxazole, 2-Benzoxazolamine, 5-nitro-
| Molecular Formula | C7H5N3O3 |
|---|---|
| Molecular Weight | 179.03 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 97.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 179.0331 |
| Heavy Atoms | 13 |
| Complexity | 218.0 |
Chemical Identifiers
| CAS Number | 64037-16-7 |
|---|---|
| SMILES | C1=CC2=C(C=C1[N+](=O)[O-])N=C(O2)N |
| InChIKey | QHVCONQZXJPGQZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-硝基-1,3-苯并噁唑-2-胺 (CAS 64037-16-7), with molecular formula C7H5N3O3 and molecular weight 179.03 g/mol. IUPAC: 5-nitro-1,3-benzoxazol-2-amine.
Chemical Property Profile of 5-硝基-1,3-苯并噁唑-2-胺
Property Insights of 5-硝基-1,3-苯并噁唑-2-胺
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-硝基-1,3-苯并噁唑-2-胺. The TPSA of 97.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-硝基-1,3-苯并噁唑-2-胺. Following Lipinski's Rule of Five, 5-硝基-1,3-苯并噁唑-2-胺 has 1 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 5-硝基-1,3-苯并噁唑-2-胺?
The CAS number of 5-硝基-1,3-苯并噁唑-2-胺 is 64037-16-7.
What is the molecular formula of 5-硝基-1,3-苯并噁唑-2-胺?
The molecular formula of 5-硝基-1,3-苯并噁唑-2-胺 is C7H5N3O3.
What is the molecular weight of 5-硝基-1,3-苯并噁唑-2-胺?
The molecular weight of 5-硝基-1,3-苯并噁唑-2-胺 is 179.03 g/mol.
Where can I buy 5-硝基-1,3-苯并噁唑-2-胺?
You can request a quote for 5-硝基-1,3-苯并噁唑-2-胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-硝基-1,3-苯并噁唑-2-胺?
Yes, KEHONG BIO provides custom synthesis services for 5-硝基-1,3-苯并噁唑-2-胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.