TL;DR: C22H26N2O6 (CAS 1212325-12-6) is a chemical compound with molecular formula C22H26N2O6 and molecular weight 414.17908 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-O'-butyl 5-O'-ethyl (3S)-2'-amino-1,6'-dimethyl-2-oxospiro[indole-3,4'-pyran]-3',5'-dicarboxylate
Also Known As: (S)-3'-butyl 5'-ethyl 2'-amino-1,6'-dimethyl-2-oxospiro[indoline-3,4'-pyran]-3',5'-dicarboxylate, 3-O'-butyl 5-O'-ethyl (3S)-2'-amino-1,6'-dimethyl-2-oxospiro[indole-3,4'-pyran]-3',5'-dicarboxylate
| Molecular Formula | C22H26N2O6 |
| Molecular Weight | 414.17908 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 108.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 414.17908 Da |
| Heavy Atoms | 30 |
| Complexity | 801.0 |
| SMILES | CCCCOC(=O)C1=C(OC(=C([C@@]12C3=CC=CC=C3N(C2=O)C)C(=O)OCC)C)N |
| InChIKey | GMWBYMZPOVNPBU-QFIPXVFZSA-N |
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for C22H26N2O6. The TPSA of 108.0 Ų falls within the moderate polarity range, balancing permeability and solubility for C22H26N2O6. Following Lipinski's Rule of Five, C22H26N2O6 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of C22H26N2O6 is 1212325-12-6.
The molecular formula of C22H26N2O6 is C22H26N2O6.
The molecular weight of C22H26N2O6 is 414.17908 g/mol.
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