![2-(4-Nitrophenyl)benzo[e][1,3]benzoxazole structure](/static/products/360/3608-45-5.png)
2-(4-Nitrophenyl)benzo[e][1,3]benzoxazole
TL;DR: 2-(4-Nitrophenyl)benzo[e][1,3]benzoxazole (CAS 3608-45-5) is a chemical compound with molecular formula C17H10N2O3 and molecular weight 290.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-nitrophenyl)benzo[e][1,3]benzoxazole
Also Known As: 2-(4-Nitrophenyl)naphtho[1,2-d]oxazole, 2-(4-nitrophenyl)benzo[e][1,3]benzoxazole, J1.980.131D, 2-(4-nitrophenyl)naphtho[1,2-d][1,3]oxazole
| Molecular Formula | C17H10N2O3 |
|---|---|
| Molecular Weight | 290.07 g/mol |
| LogP | 4.5562 |
| Topological Polar Surface Area | 69.17 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 290.06915 |
| Heavy Atoms | 22 |
| Complexity | 1003.45703 |
Chemical Identifiers
| CAS Number | 3608-45-5 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC3=C2N=C(O3)C4=CC=C(C=C4)[N+](=O)[O-] |
Product Overview
2-(4-Nitrophenyl)benzo[e][1,3]benzoxazole (CAS 3608-45-5), with molecular formula C17H10N2O3 and molecular weight 290.07 g/mol. IUPAC: 2-(4-nitrophenyl)benzo[e][1,3]benzoxazole.
Chemical Property Profile of 2-(4-Nitrophenyl)benzo[e][1,3]benzoxazole
Property Insights of 2-(4-Nitrophenyl)benzo[e][1,3]benzoxazole
The XLogP value of 4.5562 indicates that 2-(4-Nitrophenyl)benzo[e][1,3]benzoxazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.17 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-Nitrophenyl)benzo[e][1,3]benzoxazole. Following Lipinski's Rule of Five, 2-(4-Nitrophenyl)benzo[e][1,3]benzoxazole has 0 hydrogen bond donor(s) and 4 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-(4-Nitrophenyl)benzo[e][1,3]benzoxazole?
The CAS number of 2-(4-Nitrophenyl)benzo[e][1,3]benzoxazole is 3608-45-5.
What is the molecular formula of 2-(4-Nitrophenyl)benzo[e][1,3]benzoxazole?
The molecular formula of 2-(4-Nitrophenyl)benzo[e][1,3]benzoxazole is C17H10N2O3.
What is the molecular weight of 2-(4-Nitrophenyl)benzo[e][1,3]benzoxazole?
The molecular weight of 2-(4-Nitrophenyl)benzo[e][1,3]benzoxazole is 290.07 g/mol.
Where can I buy 2-(4-Nitrophenyl)benzo[e][1,3]benzoxazole?
You can request a quote for 2-(4-Nitrophenyl)benzo[e][1,3]benzoxazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Nitrophenyl)benzo[e][1,3]benzoxazole?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Nitrophenyl)benzo[e][1,3]benzoxazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.