TL;DR: (5Z)-2-(4-methylpiperazin-1-yl)-5-(thiophen-2-ylmethylidene)-1,3-thiazol-4-one (CAS 1351559-03-9) is a chemical compound with molecular formula C13H15N3OS2 and molecular weight 293.06564 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(5Z)-2-(4-methylpiperazin-1-yl)-5-(thiophen-2-ylmethylidene)-1,3-thiazol-4-one
Also Known As: (5Z)-2-(4-methylpiperazin-1-yl)-5-(thiophen-2-ylmethylidene)-1,3-thiazol-4-one, 2-(4-methyl-1-piperazinyl)-5-(2-thienylmethylene)-1,3-thiazol-4(5H)-one, 2-(4-METHYLPIPERAZINO)-5-(2-THIENYLMETHYLENE)-1,3-THIAZOL-4-ONE, (5Z)-2-(4-methylpiperazin-1-yl)-5-(thiophen-2-ylmethylidene)-1,3-thiazol-4(5H)-one, 2-(4-methylpiperazin-1-yl)-5-(thiophen-2-ylmethylidene)-1,3-thiazol-4-one
| Molecular Formula | C13H15N3OS2 |
| Molecular Weight | 293.06564 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 89.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 293.06564 Da |
| Heavy Atoms | 19 |
| Complexity | 428.0 |
| SMILES | CN1CCN(CC1)C2=NC(=O)/C(=C/C3=CC=CS3)/S2 |
| InChIKey | YJXUTVPFCCSXJK-LUAWRHEFSA-N |
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (5Z)-2-(4-methylpiperazin-1-yl)-5-(thiophen-2-ylmethylidene)-1,3-thiazol-4-one. The TPSA of 89.5 Ų falls within the moderate polarity range, balancing permeability and solubility for (5Z)-2-(4-methylpiperazin-1-yl)-5-(thiophen-2-ylmethylidene)-1,3-thiazol-4-one. Following Lipinski's Rule of Five, (5Z)-2-(4-methylpiperazin-1-yl)-5-(thiophen-2-ylmethylidene)-1,3-thiazol-4-one has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (5Z)-2-(4-methylpiperazin-1-yl)-5-(thiophen-2-ylmethylidene)-1,3-thiazol-4-one is 1351559-03-9.
The molecular formula of (5Z)-2-(4-methylpiperazin-1-yl)-5-(thiophen-2-ylmethylidene)-1,3-thiazol-4-one is C13H15N3OS2.
The molecular weight of (5Z)-2-(4-methylpiperazin-1-yl)-5-(thiophen-2-ylmethylidene)-1,3-thiazol-4-one is 293.06564 g/mol.
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