TL;DR: (3aS,8bS)-3a,8b-dihydroxy-1,3-dimethylindeno[1,2-d]imidazole-2,4-dione (CAS 1212094-95-5) is a chemical compound with molecular formula C12H12N2O4 and molecular weight 248.07971 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3aS,8bS)-3a,8b-dihydroxy-1,3-dimethylindeno[1,2-d]imidazole-2,4-dione
Also Known As: (3aS,8bS)-3a,8b-dihydroxy-1,3-dimethylindeno[1,2-d]imidazole-2,4-dione, (3aS,8aS)-3a,8a-dihydroxy-1,3-dimethyl-1,3,3a,8a-tetrahydroindeno[1,2-d]imidazole-2,8-dione
| Molecular Formula | C12H12N2O4 |
| Molecular Weight | 248.07971 g/mol |
| XLogP | -0.9 |
| Topological Polar Surface Area (TPSA) | 81.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 248.07971 Da |
| Heavy Atoms | 18 |
| Complexity | 440.0 |
| SMILES | CN1C(=O)N([C@@]2([C@]1(C3=CC=CC=C3C2=O)O)O)C |
| InChIKey | OCRUWUQNJDFMRO-NWDGAFQWSA-N |
The XLogP value of -0.9 indicates that (3aS,8bS)-3a,8b-dihydroxy-1,3-dimethylindeno[1,2-d]imidazole-2,4-dione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 81.1 Ų falls within the moderate polarity range, balancing permeability and solubility for (3aS,8bS)-3a,8b-dihydroxy-1,3-dimethylindeno[1,2-d]imidazole-2,4-dione. Following Lipinski's Rule of Five, (3aS,8bS)-3a,8b-dihydroxy-1,3-dimethylindeno[1,2-d]imidazole-2,4-dione 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 (3aS,8bS)-3a,8b-dihydroxy-1,3-dimethylindeno[1,2-d]imidazole-2,4-dione is 1212094-95-5.
The molecular formula of (3aS,8bS)-3a,8b-dihydroxy-1,3-dimethylindeno[1,2-d]imidazole-2,4-dione is C12H12N2O4.
The molecular weight of (3aS,8bS)-3a,8b-dihydroxy-1,3-dimethylindeno[1,2-d]imidazole-2,4-dione is 248.07971 g/mol.
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