TL;DR: BIM-0044098.P001 (CAS 303026-34-8) is a chemical compound with molecular formula C19H16N2O3S2 and molecular weight 384.06024 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[(5Z)-5-[[4-(dimethylamino)phenyl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]benzoic acid
Also Known As: BIM-0044098.P001, 3-{(5Z)-5-[4-(dimethylamino)benzylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}benzoic acid, (Z)-3-(5-(4-(dimethylamino)benzylidene)-4-oxo-2-thioxothiazolidin-3-yl)benzoic acid, 3-{5-[4-(dimethylamino)benzylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}benzoic acid, 3-(5-{[4-(dimethylamino)phenyl]methylene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl) benzoic acid
| Molecular Formula | C19H16N2O3S2 |
| Molecular Weight | 384.06024 g/mol |
| XLogP | 4.2 |
| Topological Polar Surface Area (TPSA) | 118.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 384.06024 Da |
| Heavy Atoms | 26 |
| Complexity | 612.0 |
| SMILES | CN(C)C1=CC=C(C=C1)/C=C\2/C(=O)N(C(=S)S2)C3=CC=CC(=C3)C(=O)O |
| InChIKey | IJBPVOAGCXNHQE-YBEGLDIGSA-N |
The XLogP value of 4.2 indicates that BIM-0044098.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 118.0 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0044098.P001. Following Lipinski's Rule of Five, BIM-0044098.P001 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of BIM-0044098.P001 is 303026-34-8.
The molecular formula of BIM-0044098.P001 is C19H16N2O3S2.
The molecular weight of BIM-0044098.P001 is 384.06024 g/mol.
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