TL;DR: IDI1_010561 (CAS 1164461-15-7) is a chemical compound with molecular formula C20H16N2O4S and molecular weight 380.08307 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[(5Z)-2,4-dioxo-5-[(E)-3-phenylprop-2-enylidene]-1,3-thiazolidin-3-yl]-N-(4-hydroxyphenyl)acetamide
Also Known As: IDI1_010561, 2-((Z)-2,4-dioxo-5-((E)-3-phenylallylidene)thiazolidin-3-yl)-N-(4-hydroxyphenyl)acetamide, F1074-0387, 2-[(5Z)-2,4-DIOXO-5-[(2E)-3-PHENYLPROP-2-EN-1-YLIDENE]-1,3-THIAZOLIDIN-3-YL]-N-(4-HYDROXYPHENYL)ACETAMIDE, 2-[(5Z)-2,4-dioxo-5-[(E)-3-phenylprop-2-enylidene]-1,3-thiazolidin-3-yl]-N-(4-hydroxyphenyl)acetamide
| Molecular Formula | C20H16N2O4S |
| Molecular Weight | 380.08307 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 112.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 380.08307 Da |
| Heavy Atoms | 27 |
| Complexity | 632.0 |
| SMILES | C1=CC=C(C=C1)/C=C/C=C\2/C(=O)N(C(=O)S2)CC(=O)NC3=CC=C(C=C3)O |
| InChIKey | LCLXIBQGTCSGBQ-GUSDSWBTSA-N |
The XLogP value of 3.6 indicates that IDI1_010561 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for IDI1_010561. Following Lipinski's Rule of Five, IDI1_010561 has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of IDI1_010561 is 1164461-15-7.
The molecular formula of IDI1_010561 is C20H16N2O4S.
The molecular weight of IDI1_010561 is 380.08307 g/mol.
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