4-Nitro-N-(3-phenyl-1,2-oxazol-5-yl)benzene-1-carboximidic acid
TL;DR: 4-Nitro-N-(3-phenyl-1,2-oxazol-5-yl)benzene-1-carboximidic acid (CAS 44978-42-9) is a chemical compound with molecular formula C16H11N3O4 and molecular weight 309.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-nitro-N-(3-phenyl-1,2-oxazol-5-yl)benzamide
Also Known As: 4-Nitro-N-(3-phenyl-5-isoxazolyl)benzamide, 4-nitro-n-(3-phenyl-1,2-oxazol-5-yl)benzamide, 4-nitro-N-(3-phenylisoxazol-5-yl)benzamide, Benzamide, 4-nitro-N-(3-phenyl-5-isoxazolyl)-, 4-Nitro-N-(3-phenyl-1,2-oxazol-5-yl)benzene-1-carboximidic acid
| Molecular Formula | C16H11N3O4 |
|---|---|
| Molecular Weight | 309.07 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 309.07495 |
| Heavy Atoms | 23 |
| Complexity | 426.0 |
Chemical Identifiers
| CAS Number | 44978-42-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NOC(=C2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-] |
| InChIKey | GOZNQLDRGXPGTB-UHFFFAOYSA-N |
Product Overview
4-Nitro-N-(3-phenyl-1,2-oxazol-5-yl)benzene-1-carboximidic acid (CAS 44978-42-9), with molecular formula C16H11N3O4 and molecular weight 309.07 g/mol. IUPAC: 4-nitro-N-(3-phenyl-1,2-oxazol-5-yl)benzamide.
Chemical Property Profile of 4-Nitro-N-(3-phenyl-1,2-oxazol-5-yl)benzene-1-carboximidic acid
Property Insights of 4-Nitro-N-(3-phenyl-1,2-oxazol-5-yl)benzene-1-carboximidic acid
The XLogP value of 3.0 indicates that 4-Nitro-N-(3-phenyl-1,2-oxazol-5-yl)benzene-1-carboximidic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Nitro-N-(3-phenyl-1,2-oxazol-5-yl)benzene-1-carboximidic acid. Following Lipinski's Rule of Five, 4-Nitro-N-(3-phenyl-1,2-oxazol-5-yl)benzene-1-carboximidic acid 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 4-Nitro-N-(3-phenyl-1,2-oxazol-5-yl)benzene-1-carboximidic acid?
The CAS number of 4-Nitro-N-(3-phenyl-1,2-oxazol-5-yl)benzene-1-carboximidic acid is 44978-42-9.
What is the molecular formula of 4-Nitro-N-(3-phenyl-1,2-oxazol-5-yl)benzene-1-carboximidic acid?
The molecular formula of 4-Nitro-N-(3-phenyl-1,2-oxazol-5-yl)benzene-1-carboximidic acid is C16H11N3O4.
What is the molecular weight of 4-Nitro-N-(3-phenyl-1,2-oxazol-5-yl)benzene-1-carboximidic acid?
The molecular weight of 4-Nitro-N-(3-phenyl-1,2-oxazol-5-yl)benzene-1-carboximidic acid is 309.07 g/mol.
Where can I buy 4-Nitro-N-(3-phenyl-1,2-oxazol-5-yl)benzene-1-carboximidic acid?
You can request a quote for 4-Nitro-N-(3-phenyl-1,2-oxazol-5-yl)benzene-1-carboximidic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Nitro-N-(3-phenyl-1,2-oxazol-5-yl)benzene-1-carboximidic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-Nitro-N-(3-phenyl-1,2-oxazol-5-yl)benzene-1-carboximidic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.