TL;DR: (2Z)-3-(1H-1,3-benzodiazol-2-yl)-N-(2,4-dichlorophenyl)-6-methoxy-2H-chromen-2-imine (CAS 1321734-37-5) is a chemical compound with molecular formula C23H15Cl2N3O2 and molecular weight 435.05414 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(1H-benzimidazol-2-yl)-N-(2,4-dichlorophenyl)-6-methoxychromen-2-imine
Also Known As: (2Z)-3-(1H-1,3-benzodiazol-2-yl)-N-(2,4-dichlorophenyl)-6-methoxy-2H-chromen-2-imine, 3-(1H-benzimidazol-2-yl)-N-(2,4-dichlorophenyl)-6-methoxychromen-2-imine, N-[(2Z)-3-(1H-benzimidazol-2-yl)-6-methoxy-2H-chromen-2-ylidene]-N-(2,4-dichlorophenyl)amine
| Molecular Formula | C23H15Cl2N3O2 |
| Molecular Weight | 435.05414 g/mol |
| XLogP | 6.2 |
| Topological Polar Surface Area (TPSA) | 59.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 435.05414 Da |
| Heavy Atoms | 30 |
| Complexity | 687.0 |
| SMILES | COC1=CC2=C(C=C1)OC(=NC3=C(C=C(C=C3)Cl)Cl)C(=C2)C4=NC5=CC=CC=C5N4 |
| InChIKey | RFZRMDHPHBAFBN-UHFFFAOYSA-N |
The XLogP value of 6.2 indicates that (2Z)-3-(1H-1,3-benzodiazol-2-yl)-N-(2,4-dichlorophenyl)-6-methoxy-2H-chromen-2-imine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.5 Ų, (2Z)-3-(1H-1,3-benzodiazol-2-yl)-N-(2,4-dichlorophenyl)-6-methoxy-2H-chromen-2-imine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2Z)-3-(1H-1,3-benzodiazol-2-yl)-N-(2,4-dichlorophenyl)-6-methoxy-2H-chromen-2-imine has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of (2Z)-3-(1H-1,3-benzodiazol-2-yl)-N-(2,4-dichlorophenyl)-6-methoxy-2H-chromen-2-imine is 1321734-37-5.
The molecular formula of (2Z)-3-(1H-1,3-benzodiazol-2-yl)-N-(2,4-dichlorophenyl)-6-methoxy-2H-chromen-2-imine is C23H15Cl2N3O2.
The molecular weight of (2Z)-3-(1H-1,3-benzodiazol-2-yl)-N-(2,4-dichlorophenyl)-6-methoxy-2H-chromen-2-imine is 435.05414 g/mol.
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