TL;DR: 4-(quinoxalin-2-ylamino)benzoic Acid (CAS 100962-05-8) is a chemical compound with molecular formula C15H11N3O2 and molecular weight 265.0851 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(quinoxalin-2-ylamino)benzoic acid
Also Known As: 4-(quinoxalin-2-ylamino)benzoic Acid, 4-(2-Quinoxalinylamino)benzoic acid, 4-(2-quinoxalinylamino)benzenecarboxylic acid, Benzoic acid,4-(2-quinoxalinylamino)-, 4-(quinoxalin-2-ylamino)benzoicAcid
| Molecular Formula | C15H11N3O2 |
| Molecular Weight | 265.0851 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 75.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 265.0851 Da |
| Heavy Atoms | 20 |
| Complexity | 342.0 |
| SMILES | C1=CC=C2C(=C1)N=CC(=N2)NC3=CC=C(C=C3)C(=O)O |
| InChIKey | GOVKQIYUNUCKKD-UHFFFAOYSA-N |
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(quinoxalin-2-ylamino)benzoic Acid. The TPSA of 75.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(quinoxalin-2-ylamino)benzoic Acid. Following Lipinski's Rule of Five, 4-(quinoxalin-2-ylamino)benzoic Acid has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 4-(quinoxalin-2-ylamino)benzoic Acid is 100962-05-8.
The molecular formula of 4-(quinoxalin-2-ylamino)benzoic Acid is C15H11N3O2.
The molecular weight of 4-(quinoxalin-2-ylamino)benzoic Acid is 265.0851 g/mol.
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