TL;DR: 3,4-Dimethoxybenzaldehyde [3-[2-(3,4-dimethoxyphenyl)ethyl ]-4-oxothiazolidin-2-ylidene]hydrazone (CAS 53068-41-0) is a chemical compound with molecular formula C22H25N3O5S and molecular weight 443.1515 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(3,4-dimethoxyphenyl)methylidenehydrazinylidene]-1,3-thiazolidin-4-one
Also Known As: 3,4-Dimethoxybenzaldehyde [3-[2-(3,4-dimethoxyphenyl)ethyl ]-4-oxothiazolidin-2-ylidene]hydrazone
| Molecular Formula | C22H25N3O5S |
| Molecular Weight | 443.1515 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 107.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 443.1515 Da |
| Heavy Atoms | 31 |
| Complexity | 647.0 |
| SMILES | COC1=C(C=C(C=C1)CCN2C(=O)CSC2=NN=CC3=CC(=C(C=C3)OC)OC)OC |
| InChIKey | XFXDPLAZRBJSIP-UHFFFAOYSA-N |
The XLogP value of 4.0 indicates that 3,4-Dimethoxybenzaldehyde [3-[2-(3,4-dimethoxyphenyl)ethyl ]-4-oxothiazolidin-2-ylidene]hydrazone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 107.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,4-Dimethoxybenzaldehyde [3-[2-(3,4-dimethoxyphenyl)ethyl ]-4-oxothiazolidin-2-ylidene]hydrazone. Following Lipinski's Rule of Five, 3,4-Dimethoxybenzaldehyde [3-[2-(3,4-dimethoxyphenyl)ethyl ]-4-oxothiazolidin-2-ylidene]hydrazone has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 3,4-Dimethoxybenzaldehyde [3-[2-(3,4-dimethoxyphenyl)ethyl ]-4-oxothiazolidin-2-ylidene]hydrazone is 53068-41-0.
The molecular formula of 3,4-Dimethoxybenzaldehyde [3-[2-(3,4-dimethoxyphenyl)ethyl ]-4-oxothiazolidin-2-ylidene]hydrazone is C22H25N3O5S.
The molecular weight of 3,4-Dimethoxybenzaldehyde [3-[2-(3,4-dimethoxyphenyl)ethyl ]-4-oxothiazolidin-2-ylidene]hydrazone is 443.1515 g/mol.
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