TL;DR: Pyrazolo(3,4-d)thiazolo(3,2-a)pyrimidin-4(1H)-one (CAS 152428-72-3) is a chemical compound with molecular formula C7H4N4OS and molecular weight 192.01057 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
10-thia-1,5,6,8-tetrazatricyclo[7.3.0.03,7]dodeca-3(7),4,8,11-tetraen-2-one
Also Known As: Pyrazolo(3,4-d)thiazolo(3,2-a)pyrimidin-4(1H)-one, 1H-Pyrazolo(3,4-d)thiazolo(3,2-a)-4H-pyrimidin-4-one, Pyrazolo[3,4-d]thiazolo[3,2-a]pyrimidin-4(1H)-one, 7-Thia-4a,8-diazacyclopent[f]indazol-4(1H)-one, (4R,5R)-4,5-dicyclohexyl-2-ethyl-1,3,2-dioxaborolane
| Molecular Formula | C7H4N4OS |
| Molecular Weight | 192.01057 g/mol |
| XLogP | 0.2 |
| Topological Polar Surface Area (TPSA) | 86.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 192.01057 Da |
| Heavy Atoms | 13 |
| Complexity | 326.0 |
| SMILES | C1=CSC2=NC3=C(C=NN3)C(=O)N21 |
| InChIKey | SUIKOQQKAJOJIZ-UHFFFAOYSA-N |
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyrazolo(3,4-d)thiazolo(3,2-a)pyrimidin-4(1H)-one. The TPSA of 86.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Pyrazolo(3,4-d)thiazolo(3,2-a)pyrimidin-4(1H)-one. Following Lipinski's Rule of Five, Pyrazolo(3,4-d)thiazolo(3,2-a)pyrimidin-4(1H)-one has 1 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 Pyrazolo(3,4-d)thiazolo(3,2-a)pyrimidin-4(1H)-one is 152428-72-3.
The molecular formula of Pyrazolo(3,4-d)thiazolo(3,2-a)pyrimidin-4(1H)-one is C7H4N4OS.
The molecular weight of Pyrazolo(3,4-d)thiazolo(3,2-a)pyrimidin-4(1H)-one is 192.01057 g/mol.
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