TL;DR: 1,3-Dihydro-3-(((2,3-dihydroxypropyl)amino)methylene)-2H-indol-2-one (CAS 159212-38-1) is a chemical compound with molecular formula C12H14N2O3 and molecular weight 234.10045 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[(2-hydroxy-1H-indol-3-yl)methylideneamino]propane-1,2-diol
Also Known As: 1,3-Dihydro-3-(((2,3-dihydroxypropyl)amino)methylene)-2H-indol-2-one, AB00092568-01, 3-[(2-hydroxy-1H-indol-3-yl)methylideneamino]propane-1,2-diol, (3E)-3-[(2,3-dihydroxypropylamino)methylidene]-1H-indol-2-one, 2H-Indol-2-one, 1,3-dihydro-3-(((2,3-dihydroxypropyl)amino)methylene)-
| Molecular Formula | C12H14N2O3 |
| Molecular Weight | 234.10045 g/mol |
| XLogP | 0.3 |
| Topological Polar Surface Area (TPSA) | 88.8 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 234.10045 Da |
| Heavy Atoms | 17 |
| Complexity | 272.0 |
| SMILES | C1=CC=C2C(=C1)C(=C(N2)O)C=NCC(CO)O |
| InChIKey | UMFWINXUCGMJQB-UHFFFAOYSA-N |
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Dihydro-3-(((2,3-dihydroxypropyl)amino)methylene)-2H-indol-2-one. The TPSA of 88.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-Dihydro-3-(((2,3-dihydroxypropyl)amino)methylene)-2H-indol-2-one. Following Lipinski's Rule of Five, 1,3-Dihydro-3-(((2,3-dihydroxypropyl)amino)methylene)-2H-indol-2-one has 4 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 1,3-Dihydro-3-(((2,3-dihydroxypropyl)amino)methylene)-2H-indol-2-one is 159212-38-1.
The molecular formula of 1,3-Dihydro-3-(((2,3-dihydroxypropyl)amino)methylene)-2H-indol-2-one is C12H14N2O3.
The molecular weight of 1,3-Dihydro-3-(((2,3-dihydroxypropyl)amino)methylene)-2H-indol-2-one is 234.10045 g/mol.
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