![N-[3-(5,6-Dimethyl-1,3-benzoxazol-2-YL)-4-hydroxyphenyl]-3-nitrobenzamide structure](/static/products/5770/5770-67-2.webp)
N-[3-(5,6-Dimethyl-1,3-benzoxazol-2-YL)-4-hydroxyphenyl]-3-nitrobenzamide
TL;DR: N-[3-(5,6-Dimethyl-1,3-benzoxazol-2-YL)-4-hydroxyphenyl]-3-nitrobenzamide (CAS 5770-67-2) is a chemical compound with molecular formula C22H17N3O5 and molecular weight 403.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-(5,6-dimethyl-1,3-benzoxazol-2-yl)-4-hydroxyphenyl]-3-nitrobenzamide
Also Known As: 2-ethyl-1,3-benzodioxole, 1,3-Benzodioxole, 2-ethyl-, AB00096362-01, N-[3-(5,6-DIMETHYL-1,3-BENZOXAZOL-2-YL)-4-HYDROXYPHENYL]-3-NITROBENZAMIDE, N-[(3E)-3-(5,6-dimethyl-3H-1,3-benzoxazol-2-ylidene)-4-oxocyclohexa-1,5-dien-1-yl]-3-nitrobenzamide
| Molecular Formula | C22H17N3O5 |
|---|---|
| Molecular Weight | 403.12 g/mol |
| LogP | 4.97774 |
| Topological Polar Surface Area | 118.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 403.11682 |
| Heavy Atoms | 30 |
| Complexity | 1270.6245 |
Chemical Identifiers
| CAS Number | 5770-67-2 |
|---|---|
| SMILES | CC1=CC2=C(C=C1C)OC(=N2)C3=C(C=CC(=C3)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-])O |
Product Overview
N-[3-(5,6-Dimethyl-1,3-benzoxazol-2-YL)-4-hydroxyphenyl]-3-nitrobenzamide (CAS 5770-67-2), with molecular formula C22H17N3O5 and molecular weight 403.12 g/mol. IUPAC: N-[3-(5,6-dimethyl-1,3-benzoxazol-2-yl)-4-hydroxyphenyl]-3-nitrobenzamide.
Chemical Property Profile of N-[3-(5,6-Dimethyl-1,3-benzoxazol-2-YL)-4-hydroxyphenyl]-3-nitrobenzamide
Property Insights of N-[3-(5,6-Dimethyl-1,3-benzoxazol-2-YL)-4-hydroxyphenyl]-3-nitrobenzamide
The XLogP value of 4.97774 indicates that N-[3-(5,6-Dimethyl-1,3-benzoxazol-2-YL)-4-hydroxyphenyl]-3-nitrobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 118.5 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[3-(5,6-Dimethyl-1,3-benzoxazol-2-YL)-4-hydroxyphenyl]-3-nitrobenzamide. Following Lipinski's Rule of Five, N-[3-(5,6-Dimethyl-1,3-benzoxazol-2-YL)-4-hydroxyphenyl]-3-nitrobenzamide has 2 hydrogen bond donor(s) and 6 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 N-[3-(5,6-Dimethyl-1,3-benzoxazol-2-YL)-4-hydroxyphenyl]-3-nitrobenzamide?
The CAS number of N-[3-(5,6-Dimethyl-1,3-benzoxazol-2-YL)-4-hydroxyphenyl]-3-nitrobenzamide is 5770-67-2.
What is the molecular formula of N-[3-(5,6-Dimethyl-1,3-benzoxazol-2-YL)-4-hydroxyphenyl]-3-nitrobenzamide?
The molecular formula of N-[3-(5,6-Dimethyl-1,3-benzoxazol-2-YL)-4-hydroxyphenyl]-3-nitrobenzamide is C22H17N3O5.
What is the molecular weight of N-[3-(5,6-Dimethyl-1,3-benzoxazol-2-YL)-4-hydroxyphenyl]-3-nitrobenzamide?
The molecular weight of N-[3-(5,6-Dimethyl-1,3-benzoxazol-2-YL)-4-hydroxyphenyl]-3-nitrobenzamide is 403.12 g/mol.
Where can I buy N-[3-(5,6-Dimethyl-1,3-benzoxazol-2-YL)-4-hydroxyphenyl]-3-nitrobenzamide?
You can request a quote for N-[3-(5,6-Dimethyl-1,3-benzoxazol-2-YL)-4-hydroxyphenyl]-3-nitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[3-(5,6-Dimethyl-1,3-benzoxazol-2-YL)-4-hydroxyphenyl]-3-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[3-(5,6-Dimethyl-1,3-benzoxazol-2-YL)-4-hydroxyphenyl]-3-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.