TL;DR: (Z)-2-(4-methylpiperidin-1-yl)-5-((1-phenyl-3-(3-propoxyphenyl)-1H-pyrazol-4-yl)methylene)thiazol-4(5H)-one (CAS 1009438-50-9) is a chemical compound with molecular formula C28H30N4O2S and molecular weight 486.20895 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(5Z)-2-(4-methylpiperidin-1-yl)-5-[[1-phenyl-3-(3-propoxyphenyl)pyrazol-4-yl]methylidene]-1,3-thiazol-4-one
Also Known As: (Z)-2-(4-methylpiperidin-1-yl)-5-((1-phenyl-3-(3-propoxyphenyl)-1H-pyrazol-4-yl)methylene)thiazol-4(5H)-one, 2-(4-methylpiperidino)-5-{(Z)-1-[1-phenyl-3-(3-propoxyphenyl)-1H-pyrazol-4-yl]methylidene}-1,3-thiazol-4-one, (5Z)-2-(4-methylpiperidin-1-yl)-5-[[1-phenyl-3-(3-propoxyphenyl)pyrazol-4-yl]methylidene]-1,3-thiazol-4-one, (5Z)-2-(4-methylpiperidin-1-yl)-5-{[1-phenyl-3-(3-propoxyphenyl)-1H-pyrazol-4-yl]methylidene}-1,3-thiazol-4(5H)-one, (5Z)-2-(4-METHYLPIPERIDIN-1-YL)-5-{[1-PHENYL-3-(3-PROPOXYPHENYL)-1H-PYRAZOL-4-YL]METHYLIDENE}-4,5-DIHYDRO-1,3-THIAZOL-4-ONE
| Molecular Formula | C28H30N4O2S |
| Molecular Weight | 486.20895 g/mol |
| XLogP | 6.2 |
| Topological Polar Surface Area (TPSA) | 85.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 486.20895 Da |
| Heavy Atoms | 35 |
| Complexity | 788.0 |
| SMILES | CCCOC1=CC=CC(=C1)C2=NN(C=C2/C=C\3/C(=O)N=C(S3)N4CCC(CC4)C)C5=CC=CC=C5 |
| InChIKey | FPHMTWBZCMGQRO-BWAHOGKJSA-N |
The XLogP value of 6.2 indicates that (Z)-2-(4-methylpiperidin-1-yl)-5-((1-phenyl-3-(3-propoxyphenyl)-1H-pyrazol-4-yl)methylene)thiazol-4(5H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-2-(4-methylpiperidin-1-yl)-5-((1-phenyl-3-(3-propoxyphenyl)-1H-pyrazol-4-yl)methylene)thiazol-4(5H)-one. Following Lipinski's Rule of Five, (Z)-2-(4-methylpiperidin-1-yl)-5-((1-phenyl-3-(3-propoxyphenyl)-1H-pyrazol-4-yl)methylene)thiazol-4(5H)-one has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of (Z)-2-(4-methylpiperidin-1-yl)-5-((1-phenyl-3-(3-propoxyphenyl)-1H-pyrazol-4-yl)methylene)thiazol-4(5H)-one is 1009438-50-9.
The molecular formula of (Z)-2-(4-methylpiperidin-1-yl)-5-((1-phenyl-3-(3-propoxyphenyl)-1H-pyrazol-4-yl)methylene)thiazol-4(5H)-one is C28H30N4O2S.
The molecular weight of (Z)-2-(4-methylpiperidin-1-yl)-5-((1-phenyl-3-(3-propoxyphenyl)-1H-pyrazol-4-yl)methylene)thiazol-4(5H)-one is 486.20895 g/mol.
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