N-苯甲酰靛红酸
TL;DR: N-苯甲酰靛红酸 (CAS 6333-78-4) is a chemical compound with molecular formula C15H11NO4 and molecular weight 269.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-苯甲酰靛红酸
2-(2-benzamidophenyl)-2-oxoacetic acid
Also Known As: N-Benzoylisatinic acid, 2-(2-benzamidophenyl)-2-oxoacetic acid, o-(benzoyl-amino)phenylglyoxylic acid, 2-Chloro-1H-indole-3-carboxylic acid, N-[2-[Carboxycarbonyl]phenyl]benzamide
| Molecular Formula | C15H11NO4 |
|---|---|
| Molecular Weight | 269.07 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 83.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 269.06882 |
| Heavy Atoms | 20 |
| Complexity | 387.0 |
Chemical Identifiers
| CAS Number | 6333-78-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)NC2=CC=CC=C2C(=O)C(=O)O |
| InChIKey | HNSQYKSPPRPHPX-UHFFFAOYSA-N |
Product Overview
N-苯甲酰靛红酸 (CAS 6333-78-4), with molecular formula C15H11NO4 and molecular weight 269.07 g/mol. IUPAC: 2-(2-benzamidophenyl)-2-oxoacetic acid.
Chemical Property Profile of N-苯甲酰靛红酸
Property Insights of N-苯甲酰靛红酸
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-苯甲酰靛红酸. The TPSA of 83.5 Ų falls within the moderate polarity range, balancing permeability and solubility for N-苯甲酰靛红酸. Following Lipinski's Rule of Five, N-苯甲酰靛红酸 has 2 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 N-苯甲酰靛红酸?
The CAS number of N-苯甲酰靛红酸 is 6333-78-4.
What is the molecular formula of N-苯甲酰靛红酸?
The molecular formula of N-苯甲酰靛红酸 is C15H11NO4.
What is the molecular weight of N-苯甲酰靛红酸?
The molecular weight of N-苯甲酰靛红酸 is 269.07 g/mol.
Where can I buy N-苯甲酰靛红酸?
You can request a quote for N-苯甲酰靛红酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-苯甲酰靛红酸?
Yes, KEHONG BIO provides custom synthesis services for N-苯甲酰靛红酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.