(3-Indolylmethylene)-4-chloroanthranilic acid
TL;DR: (3-Indolylmethylene)-4-chloroanthranilic acid (CAS 22394-35-0) is a chemical compound with molecular formula C16H11ClN2O2 and molecular weight 298.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-2-(1H-indol-3-ylmethylideneamino)benzoic acid
Also Known As: 4-Chloro-2- benzoicacid, (3-Indolylmethylene)-4-chloroanthranilic acid, Anthranilic acid, 4-chloro-N-(indol-3-ylmethylene)-, 5-21-08-00248 (Beilstein Handbook Reference), 4-chloro-2-(indol-3-ylidenemethylamino)benzoic acid
| Molecular Formula | C16H11ClN2O2 |
|---|---|
| Molecular Weight | 298.05 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 65.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 298.0509 |
| Heavy Atoms | 21 |
| Complexity | 415.0 |
Chemical Identifiers
| CAS Number | 22394-35-0 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CN2)C=NC3=C(C=CC(=C3)Cl)C(=O)O |
| InChIKey | ANTCCAUGGSQGIR-UHFFFAOYSA-N |
Product Overview
(3-Indolylmethylene)-4-chloroanthranilic acid (CAS 22394-35-0), with molecular formula C16H11ClN2O2 and molecular weight 298.05 g/mol. IUPAC: 4-chloro-2-(1H-indol-3-ylmethylideneamino)benzoic acid.
Chemical Property Profile of (3-Indolylmethylene)-4-chloroanthranilic acid
Property Insights of (3-Indolylmethylene)-4-chloroanthranilic acid
The XLogP value of 3.5 indicates that (3-Indolylmethylene)-4-chloroanthranilic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.5 Ų falls within the moderate polarity range, balancing permeability and solubility for (3-Indolylmethylene)-4-chloroanthranilic acid. Following Lipinski's Rule of Five, (3-Indolylmethylene)-4-chloroanthranilic acid 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 (3-Indolylmethylene)-4-chloroanthranilic acid?
The CAS number of (3-Indolylmethylene)-4-chloroanthranilic acid is 22394-35-0.
What is the molecular formula of (3-Indolylmethylene)-4-chloroanthranilic acid?
The molecular formula of (3-Indolylmethylene)-4-chloroanthranilic acid is C16H11ClN2O2.
What is the molecular weight of (3-Indolylmethylene)-4-chloroanthranilic acid?
The molecular weight of (3-Indolylmethylene)-4-chloroanthranilic acid is 298.05 g/mol.
Where can I buy (3-Indolylmethylene)-4-chloroanthranilic acid?
You can request a quote for (3-Indolylmethylene)-4-chloroanthranilic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3-Indolylmethylene)-4-chloroanthranilic acid?
Yes, KEHONG BIO provides custom synthesis services for (3-Indolylmethylene)-4-chloroanthranilic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.