TL;DR: (5Z)-2-(4-methylpiperazin-1-yl)-5-(3,4,5-trimethoxybenzylidene)-1,3-thiazol-4(5H)-one (CAS 585550-25-0) is a chemical compound with molecular formula C18H23N3O4S and molecular weight 377.14093 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(5Z)-2-(4-methylpiperazin-1-yl)-5-[(3,4,5-trimethoxyphenyl)methylidene]-1,3-thiazol-4-one
Also Known As: (5Z)-2-(4-methylpiperazin-1-yl)-5-(3,4,5-trimethoxybenzylidene)-1,3-thiazol-4(5H)-one, (Z)-2-(4-methylpiperazin-1-yl)-5-(3,4,5-trimethoxybenzylidene)thiazol-4(5H)-one, 2-(4-methylpiperazin-1-yl)-5-[(3,4,5-trimethoxyphenyl)methylidene]-1,3-thiazol-4-one, (5Z)-2-(4-methylpiperazin-1-yl)-5-[(3,4,5-trimethoxyphenyl)methylidene]-1,3-thiazol-4-one, (5Z)-2-(4-METHYLPIPERAZIN-1-YL)-5-[(3,4,5-TRIMETHOXYPHENYL)METHYLIDENE]-4,5-DIHYDRO-1,3-THIAZOL-4-ONE
| Molecular Formula | C18H23N3O4S |
| Molecular Weight | 377.14093 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 88.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 377.14093 Da |
| Heavy Atoms | 26 |
| Complexity | 561.0 |
| SMILES | CN1CCN(CC1)C2=NC(=O)/C(=C/C3=CC(=C(C(=C3)OC)OC)OC)/S2 |
| InChIKey | IPVPSADWTZTGLP-PTNGSMBKSA-N |
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (5Z)-2-(4-methylpiperazin-1-yl)-5-(3,4,5-trimethoxybenzylidene)-1,3-thiazol-4(5H)-one. The TPSA of 88.9 Ų falls within the moderate polarity range, balancing permeability and solubility for (5Z)-2-(4-methylpiperazin-1-yl)-5-(3,4,5-trimethoxybenzylidene)-1,3-thiazol-4(5H)-one. Following Lipinski's Rule of Five, (5Z)-2-(4-methylpiperazin-1-yl)-5-(3,4,5-trimethoxybenzylidene)-1,3-thiazol-4(5H)-one has 0 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 (5Z)-2-(4-methylpiperazin-1-yl)-5-(3,4,5-trimethoxybenzylidene)-1,3-thiazol-4(5H)-one is 585550-25-0.
The molecular formula of (5Z)-2-(4-methylpiperazin-1-yl)-5-(3,4,5-trimethoxybenzylidene)-1,3-thiazol-4(5H)-one is C18H23N3O4S.
The molecular weight of (5Z)-2-(4-methylpiperazin-1-yl)-5-(3,4,5-trimethoxybenzylidene)-1,3-thiazol-4(5H)-one is 377.14093 g/mol.
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