TL;DR: 3-chloro-N-[(E)-1-(furan-2-yl)ethylideneamino]benzamide (CAS 113906-39-1) is a chemical compound with molecular formula C13H11ClN2O2 and molecular weight 262.0509 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-chloro-N-[(E)-1-(furan-2-yl)ethylideneamino]benzamide
Also Known As: BAS 00320429, 3-chloro-N'-[1-(2-furyl)ethylidene]benzohydrazide, 3-chloro-N-[(E)-1-(furan-2-yl)ethylideneamino]benzamide, AN-329/09187036, 3-Chloro-N/'-[1-(2-furyl)ethylidene]benzohydrazide
| Molecular Formula | C13H11ClN2O2 |
| Molecular Weight | 262.0509 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 54.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 262.0509 Da |
| Heavy Atoms | 18 |
| Complexity | 333.0 |
| SMILES | C/C(=N\NC(=O)C1=CC(=CC=C1)Cl)/C2=CC=CO2 |
| InChIKey | SDSBIXZBROTQIP-OQLLNIDSSA-N |
The XLogP value of 3.1 indicates that 3-chloro-N-[(E)-1-(furan-2-yl)ethylideneamino]benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.6 Ų, 3-chloro-N-[(E)-1-(furan-2-yl)ethylideneamino]benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-chloro-N-[(E)-1-(furan-2-yl)ethylideneamino]benzamide 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 3-chloro-N-[(E)-1-(furan-2-yl)ethylideneamino]benzamide is 113906-39-1.
The molecular formula of 3-chloro-N-[(E)-1-(furan-2-yl)ethylideneamino]benzamide is C13H11ClN2O2.
The molecular weight of 3-chloro-N-[(E)-1-(furan-2-yl)ethylideneamino]benzamide is 262.0509 g/mol.
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