TL;DR: 5-methyl 2-(2-methylcyclopentyl) 3,6-dimethyl-4-oxo-4,5,6,7-tetrahydro-1H-indole-2,5-dicarboxylate (CAS 1005125-12-1) is a chemical compound with molecular formula C19H25NO5 and molecular weight 347.17328 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-O-methyl 2-O-(2-methylcyclopentyl) 3,6-dimethyl-4-oxo-1,5,6,7-tetrahydroindole-2,5-dicarboxylate
Also Known As: 5-methyl 2-(2-methylcyclopentyl) 3,6-dimethyl-4-oxo-4,5,6,7-tetrahydro-1H-indole-2,5-dicarboxylate, 5-O-methyl 2-O-(2-methylcyclopentyl) 3,6-dimethyl-4-oxo-1,5,6,7-tetrahydroindole-2,5-dicarboxylate, methyl 3,6-dimethyl-2-[(2-methylcyclopentyl)oxycarbonyl]-4-oxo-5,6,7-trihydroi ndole-5-carboxylate
| Molecular Formula | C19H25NO5 |
| Molecular Weight | 347.17328 g/mol |
| XLogP | 3.7 |
| Topological Polar Surface Area (TPSA) | 85.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 347.17328 Da |
| Heavy Atoms | 25 |
| Complexity | 562.0 |
| SMILES | CC1CCCC1OC(=O)C2=C(C3=C(N2)CC(C(C3=O)C(=O)OC)C)C |
| InChIKey | PZUFJJVCCIFCJD-UHFFFAOYSA-N |
The XLogP value of 3.7 indicates that 5-methyl 2-(2-methylcyclopentyl) 3,6-dimethyl-4-oxo-4,5,6,7-tetrahydro-1H-indole-2,5-dicarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-methyl 2-(2-methylcyclopentyl) 3,6-dimethyl-4-oxo-4,5,6,7-tetrahydro-1H-indole-2,5-dicarboxylate. Following Lipinski's Rule of Five, 5-methyl 2-(2-methylcyclopentyl) 3,6-dimethyl-4-oxo-4,5,6,7-tetrahydro-1H-indole-2,5-dicarboxylate has 1 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 5-methyl 2-(2-methylcyclopentyl) 3,6-dimethyl-4-oxo-4,5,6,7-tetrahydro-1H-indole-2,5-dicarboxylate is 1005125-12-1.
The molecular formula of 5-methyl 2-(2-methylcyclopentyl) 3,6-dimethyl-4-oxo-4,5,6,7-tetrahydro-1H-indole-2,5-dicarboxylate is C19H25NO5.
The molecular weight of 5-methyl 2-(2-methylcyclopentyl) 3,6-dimethyl-4-oxo-4,5,6,7-tetrahydro-1H-indole-2,5-dicarboxylate is 347.17328 g/mol.
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