TL;DR: 2H-Indol-2-one, 1,3-dihydro-5-hydroxy-3-(((phenylmethyl)amino)methylene)-, (E)- (CAS 159212-45-0) is a chemical compound with molecular formula C16H14N2O2 and molecular weight 266.10553 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(benzyliminomethyl)-1H-indole-2,5-diol
Also Known As: 1,3-Dihydro-5-hydroxy-3-(((phenylmethyl)amino)methylene)-2H-indol-2-one (E)-, 2H-Indol-2-one, 1,3-dihydro-5-hydroxy-3-(((phenylmethyl)amino)methylene)-, (E)-, (Z)-3-((benzylamino)methylene)-5-hydroxyindolin-2-one, 3-[(benzylamino)methylidene]-5-hydroxy-1H-indol-2-one, (3E)-3-[(benzylamino)methylidene]-5-hydroxy-1H-indol-2-one
| Molecular Formula | C16H14N2O2 |
| Molecular Weight | 266.10553 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 68.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 266.10553 Da |
| Heavy Atoms | 20 |
| Complexity | 341.0 |
| SMILES | C1=CC=C(C=C1)CN=CC2=C(NC3=C2C=C(C=C3)O)O |
| InChIKey | ABRYCRNFZNBJQB-UHFFFAOYSA-N |
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2H-Indol-2-one, 1,3-dihydro-5-hydroxy-3-(((phenylmethyl)amino)methylene)-, (E)-. The TPSA of 68.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2H-Indol-2-one, 1,3-dihydro-5-hydroxy-3-(((phenylmethyl)amino)methylene)-, (E)-. Following Lipinski's Rule of Five, 2H-Indol-2-one, 1,3-dihydro-5-hydroxy-3-(((phenylmethyl)amino)methylene)-, (E)- has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2H-Indol-2-one, 1,3-dihydro-5-hydroxy-3-(((phenylmethyl)amino)methylene)-, (E)- is 159212-45-0.
The molecular formula of 2H-Indol-2-one, 1,3-dihydro-5-hydroxy-3-(((phenylmethyl)amino)methylene)-, (E)- is C16H14N2O2.
The molecular weight of 2H-Indol-2-one, 1,3-dihydro-5-hydroxy-3-(((phenylmethyl)amino)methylene)-, (E)- is 266.10553 g/mol.
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