TL;DR: 5H-[1,3]dioxolo[4,5-f]indole-6-carboxylic acid (CAS 106517-64-0) is a chemical compound with molecular formula C10H7NO4 and molecular weight 205.0375 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5H-[1,3]dioxolo[4,5-f]indole-6-carboxylic acid
Also Known As: 5H-[1,3]dioxolo[4,5-f]indole-6-carboxylic acid, 5,6-methylenedioxyindolyl-2-carboxylic acid, 5H-1,3-Dioxolo[4,5-f]indole-6-carboxylicacid, 5H-1,3Dioxolo4,5-findole-6-carboxylic acid, 5,6-Methylenedioxyindole-2-carboxylic acid
| Molecular Formula | C10H7NO4 |
| Molecular Weight | 205.0375 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 71.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 205.0375 Da |
| Heavy Atoms | 15 |
| Complexity | 283.0 |
| SMILES | C1OC2=C(O1)C=C3C(=C2)C=C(N3)C(=O)O |
| InChIKey | BJRAHWGTBUCWCY-UHFFFAOYSA-N |
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5H-[1,3]dioxolo[4,5-f]indole-6-carboxylic acid. The TPSA of 71.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 5H-[1,3]dioxolo[4,5-f]indole-6-carboxylic acid. Following Lipinski's Rule of Five, 5H-[1,3]dioxolo[4,5-f]indole-6-carboxylic acid has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 5H-[1,3]dioxolo[4,5-f]indole-6-carboxylic acid is 106517-64-0.
The molecular formula of 5H-[1,3]dioxolo[4,5-f]indole-6-carboxylic acid is C10H7NO4.
The molecular weight of 5H-[1,3]dioxolo[4,5-f]indole-6-carboxylic acid is 205.0375 g/mol.
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