邻苯二甲酰苯胺酸
TL;DR: 邻苯二甲酰苯胺酸 (CAS 4727-29-1) is a chemical compound with molecular formula C14H11NO3 and molecular weight 241.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
邻苯二甲酰苯胺酸
2-(phenylcarbamoyl)benzoic acid
Also Known As: phthalanillic acid, Phthalanilic acid, Lemax, 2-(phenylcarbamoyl)benzoic acid, Nevirol
| Molecular Formula | C14H11NO3 |
|---|---|
| Molecular Weight | 241.07 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 241.0739 |
| Heavy Atoms | 18 |
| Complexity | 310.0 |
Chemical Identifiers
| CAS Number | 4727-29-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC(=O)C2=CC=CC=C2C(=O)O |
| InChIKey | DSUPUOGOCIFZBG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
邻苯二甲酰苯胺酸 (CAS 4727-29-1), with molecular formula C14H11NO3 and molecular weight 241.07 g/mol. IUPAC: 2-(phenylcarbamoyl)benzoic acid.
Chemical Property Profile of 邻苯二甲酰苯胺酸
Property Insights of 邻苯二甲酰苯胺酸
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 邻苯二甲酰苯胺酸. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 邻苯二甲酰苯胺酸. Following Lipinski's Rule of Five, 邻苯二甲酰苯胺酸 has 2 hydrogen bond donor(s) and 3 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 邻苯二甲酰苯胺酸?
The CAS number of 邻苯二甲酰苯胺酸 is 4727-29-1.
What is the molecular formula of 邻苯二甲酰苯胺酸?
The molecular formula of 邻苯二甲酰苯胺酸 is C14H11NO3.
What is the molecular weight of 邻苯二甲酰苯胺酸?
The molecular weight of 邻苯二甲酰苯胺酸 is 241.07 g/mol.
Where can I buy 邻苯二甲酰苯胺酸?
You can request a quote for 邻苯二甲酰苯胺酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 邻苯二甲酰苯胺酸?
Yes, KEHONG BIO provides custom synthesis services for 邻苯二甲酰苯胺酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.