TL;DR: BAS 00564884 (CAS 15296-13-6) is a chemical compound with molecular formula C18H22N2O3S2 and molecular weight 378.10718 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-[(5E)-5-[[4-(dimethylamino)phenyl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoic acid
Also Known As: BAS 00564884, 6-(5-{[4-(DIMETHYLAMINO)PHENYL]METHYLIDENE}-4-OXO-2-SULFANYLIDENE-1,3-THIAZOLIDIN-3-YL)HEXANOIC ACID, 6-[(5E)-5-[(4-dimethylaminophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoic acid
| Molecular Formula | C18H22N2O3S2 |
| Molecular Weight | 378.10718 g/mol |
| XLogP | 3.7 |
| Topological Polar Surface Area (TPSA) | 118.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 378.10718 Da |
| Heavy Atoms | 25 |
| Complexity | 540.0 |
| SMILES | CN(C)C1=CC=C(C=C1)/C=C/2\C(=O)N(C(=S)S2)CCCCCC(=O)O |
| InChIKey | DRIZUSKVXOXVBK-NTCAYCPXSA-N |
The XLogP value of 3.7 indicates that BAS 00564884 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 BAS 00564884. Following Lipinski's Rule of Five, BAS 00564884 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 BAS 00564884 is 15296-13-6.
The molecular formula of BAS 00564884 is C18H22N2O3S2.
The molecular weight of BAS 00564884 is 378.10718 g/mol.
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