Benzoxazole, 5-nitro-2-(3-pyridinyl)-
TL;DR: Benzoxazole, 5-nitro-2-(3-pyridinyl)- (CAS 61382-20-5) is a chemical compound with molecular formula C12H7N3O3 and molecular weight 241.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-nitro-2-pyridin-3-yl-1,3-benzoxazole
Also Known As: Benzoxazole, 5-nitro-2-(3-pyridinyl)-, 5-Nitro-2-pyridin-3-yl-benzooxazole, 5-nitro-2-pyridin-3-yl-1,3-benzoxazole, 5-Nitro-2-(3-pyridinyl)benzoxazole, BAS 00398707
| Molecular Formula | C12H7N3O3 |
|---|---|
| Molecular Weight | 241.05 g/mol |
| LogP | 2.798 |
| Topological Polar Surface Area | 82.06 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 241.04874 |
| Heavy Atoms | 18 |
| Complexity | 721.7706 |
Chemical Identifiers
| CAS Number | 61382-20-5 |
|---|---|
| SMILES | C1=CC(=CN=C1)C2=NC3=C(O2)C=CC(=C3)[N+](=O)[O-] |
Product Overview
Benzoxazole, 5-nitro-2-(3-pyridinyl)- (CAS 61382-20-5), with molecular formula C12H7N3O3 and molecular weight 241.05 g/mol. IUPAC: 5-nitro-2-pyridin-3-yl-1,3-benzoxazole.
Chemical Property Profile of Benzoxazole, 5-nitro-2-(3-pyridinyl)-
Property Insights of Benzoxazole, 5-nitro-2-(3-pyridinyl)-
The XLogP value of 2.798 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzoxazole, 5-nitro-2-(3-pyridinyl)-. The TPSA of 82.06 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoxazole, 5-nitro-2-(3-pyridinyl)-. Following Lipinski's Rule of Five, Benzoxazole, 5-nitro-2-(3-pyridinyl)- has 0 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 Benzoxazole, 5-nitro-2-(3-pyridinyl)-?
The CAS number of Benzoxazole, 5-nitro-2-(3-pyridinyl)- is 61382-20-5.
What is the molecular formula of Benzoxazole, 5-nitro-2-(3-pyridinyl)-?
The molecular formula of Benzoxazole, 5-nitro-2-(3-pyridinyl)- is C12H7N3O3.
What is the molecular weight of Benzoxazole, 5-nitro-2-(3-pyridinyl)-?
The molecular weight of Benzoxazole, 5-nitro-2-(3-pyridinyl)- is 241.05 g/mol.
Where can I buy Benzoxazole, 5-nitro-2-(3-pyridinyl)-?
You can request a quote for Benzoxazole, 5-nitro-2-(3-pyridinyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoxazole, 5-nitro-2-(3-pyridinyl)-?
Yes, KEHONG BIO provides custom synthesis services for Benzoxazole, 5-nitro-2-(3-pyridinyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.