TL;DR: C22H26N2O7 (CAS 1212223-05-6) is a chemical compound with molecular formula C22H26N2O7 and molecular weight 430.174 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-O'-butyl 5-O'-(2-methoxyethyl) (3S)-2'-amino-6'-methyl-2-oxospiro[1H-indole-3,4'-pyran]-3',5'-dicarboxylate
Also Known As: (S)-3'-butyl 5'-(2-methoxyethyl) 2'-amino-6'-methyl-2-oxospiro[indoline-3,4'-pyran]-3',5'-dicarboxylate, 3-O'-butyl 5-O'-(2-methoxyethyl) (3S)-2'-amino-6'-methyl-2-oxospiro[1H-indole-3,4'-pyran]-3',5'-dicarboxylate
| Molecular Formula | C22H26N2O7 |
| Molecular Weight | 430.174 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 126.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 430.174 Da |
| Heavy Atoms | 31 |
| Complexity | 804.0 |
| SMILES | CCCCOC(=O)C1=C(OC(=C([C@@]12C3=CC=CC=C3NC2=O)C(=O)OCCOC)C)N |
| InChIKey | AJTRHOSDDGBAEE-QFIPXVFZSA-N |
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for C22H26N2O7. The TPSA of 126.0 Ų falls within the moderate polarity range, balancing permeability and solubility for C22H26N2O7. Following Lipinski's Rule of Five, C22H26N2O7 has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of C22H26N2O7 is 1212223-05-6.
The molecular formula of C22H26N2O7 is C22H26N2O7.
The molecular weight of C22H26N2O7 is 430.174 g/mol.
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