TL;DR: (E)-4-(((1H-indol-3-yl)methylene)amino)phenol (CAS 118380-30-6) is a chemical compound with molecular formula C15H12N2O and molecular weight 236.09496 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(1H-indol-3-ylmethylideneamino)phenol
Also Known As: (E)-4-(((1H-indol-3-yl)methylene)amino)phenol, 4-(1H-indol-3-ylmethylideneamino)phenol, 4-[(E)-[(1H-indol-3-yl)methylidene]amino]phenol, 4-(indol-3-ylidenemethylamino)phenol, IDI1_019831
| Molecular Formula | C15H12N2O |
| Molecular Weight | 236.09496 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 48.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 236.09496 Da |
| Heavy Atoms | 18 |
| Complexity | 297.0 |
| SMILES | C1=CC=C2C(=C1)C(=CN2)C=NC3=CC=C(C=C3)O |
| InChIKey | YSJOHAQUDMOXRF-UHFFFAOYSA-N |
The XLogP value of 3.2 indicates that (E)-4-(((1H-indol-3-yl)methylene)amino)phenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.4 Ų, (E)-4-(((1H-indol-3-yl)methylene)amino)phenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-4-(((1H-indol-3-yl)methylene)amino)phenol has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (E)-4-(((1H-indol-3-yl)methylene)amino)phenol is 118380-30-6.
The molecular formula of (E)-4-(((1H-indol-3-yl)methylene)amino)phenol is C15H12N2O.
The molecular weight of (E)-4-(((1H-indol-3-yl)methylene)amino)phenol is 236.09496 g/mol.
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