TL;DR: 4,6,7-Trimethoxy-1H-indole-2-carboxylic acid (CAS 151021-12-4) is a chemical compound with molecular formula C12H13NO5 and molecular weight 251.07938 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4,6,7-trimethoxy-1H-indole-2-carboxylic acid
Also Known As: 4,6,7-Trimethoxy-1H-indole-2-carboxylic acid, 4,6,7-Trimethoxyindole-2-carboxylic acid, ASN 07743704, 4,6,7-Trimethoxy-1H-indole-2-carboxylicacid
| Molecular Formula | C12H13NO5 |
| Molecular Weight | 251.07938 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 80.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 251.07938 Da |
| Heavy Atoms | 18 |
| Complexity | 311.0 |
| SMILES | COC1=CC(=C(C2=C1C=C(N2)C(=O)O)OC)OC |
| InChIKey | QVCJMJQXKVYHCL-UHFFFAOYSA-N |
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,6,7-Trimethoxy-1H-indole-2-carboxylic acid. The TPSA of 80.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,6,7-Trimethoxy-1H-indole-2-carboxylic acid. Following Lipinski's Rule of Five, 4,6,7-Trimethoxy-1H-indole-2-carboxylic 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 4,6,7-Trimethoxy-1H-indole-2-carboxylic acid is 151021-12-4.
The molecular formula of 4,6,7-Trimethoxy-1H-indole-2-carboxylic acid is C12H13NO5.
The molecular weight of 4,6,7-Trimethoxy-1H-indole-2-carboxylic acid is 251.07938 g/mol.
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