TL;DR: 4-[(3-Chloro-1-benzothiophen-2-yl)methylideneamino]phenol (CAS 1164508-16-0) is a chemical compound with molecular formula C15H10ClNOS and molecular weight 287.01715 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[(3-chloro-1-benzothiophen-2-yl)methylideneamino]phenol
Also Known As: AE-848/30703024, 4-[(3-chloro-1-benzothiophen-2-yl)methylideneamino]phenol, Phenol, 4-(3-chloro-2-benzothienyl)methylenamino-, 4-[(3-chlorobenzothiophen-2-yl)methyleneamino]phenol, (E)-4-(((3-chlorobenzo[b]thiophen-2-yl)methylene)amino)phenol
| Molecular Formula | C15H10ClNOS |
| Molecular Weight | 287.01715 g/mol |
| XLogP | 4.8 |
| Topological Polar Surface Area (TPSA) | 60.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 287.01715 Da |
| Heavy Atoms | 19 |
| Complexity | 330.0 |
| SMILES | C1=CC=C2C(=C1)C(=C(S2)C=NC3=CC=C(C=C3)O)Cl |
| InChIKey | LJJDNVLRFSTAGH-UHFFFAOYSA-N |
The XLogP value of 4.8 indicates that 4-[(3-Chloro-1-benzothiophen-2-yl)methylideneamino]phenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[(3-Chloro-1-benzothiophen-2-yl)methylideneamino]phenol. Following Lipinski's Rule of Five, 4-[(3-Chloro-1-benzothiophen-2-yl)methylideneamino]phenol has 1 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 4-[(3-Chloro-1-benzothiophen-2-yl)methylideneamino]phenol is 1164508-16-0.
The molecular formula of 4-[(3-Chloro-1-benzothiophen-2-yl)methylideneamino]phenol is C15H10ClNOS.
The molecular weight of 4-[(3-Chloro-1-benzothiophen-2-yl)methylideneamino]phenol is 287.01715 g/mol.
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