TL;DR: Pyrazolo(3,4-d)thiazolo(3,2-a)pyrimidin-4(1H)-one, 1-methyl-6-phenyl- (CAS 152423-13-7) is a chemical compound with molecular formula C14H10N4OS and molecular weight 282.05753 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-methyl-12-phenyl-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, 1-methyl-6-phenyl-, 1-Methyl-6-phenylpyrazolo(3,4-d)thiazolo(3,2-a)pyrimidin-4(1H)-one, 1-Methyl-5-phenyl-7-thia-4a,8-diazacyclopent[f]indazol-4(1H)-one, 1-Methyl-6-phenylpyrazolo[3,4-d][1,3]thiazolo[3,2-a]pyrimidin-4(1H)-one, 6-methyl-12-phenyl-10-thia-1,5,6,8-tetraazatricyclo[7.3.0.03,7]dodeca-3(7),4,8,11-tetraen-2-one
| Molecular Formula | C14H10N4OS |
| Molecular Weight | 282.05753 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 75.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 282.05753 Da |
| Heavy Atoms | 20 |
| Complexity | 497.0 |
| SMILES | CN1C2=C(C=N1)C(=O)N3C(=CSC3=N2)C4=CC=CC=C4 |
| InChIKey | AKVOIQHFRCVCAF-UHFFFAOYSA-N |
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyrazolo(3,4-d)thiazolo(3,2-a)pyrimidin-4(1H)-one, 1-methyl-6-phenyl-. The TPSA of 75.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Pyrazolo(3,4-d)thiazolo(3,2-a)pyrimidin-4(1H)-one, 1-methyl-6-phenyl-. Following Lipinski's Rule of Five, Pyrazolo(3,4-d)thiazolo(3,2-a)pyrimidin-4(1H)-one, 1-methyl-6-phenyl- 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 Pyrazolo(3,4-d)thiazolo(3,2-a)pyrimidin-4(1H)-one, 1-methyl-6-phenyl- is 152423-13-7.
The molecular formula of Pyrazolo(3,4-d)thiazolo(3,2-a)pyrimidin-4(1H)-one, 1-methyl-6-phenyl- is C14H10N4OS.
The molecular weight of Pyrazolo(3,4-d)thiazolo(3,2-a)pyrimidin-4(1H)-one, 1-methyl-6-phenyl- is 282.05753 g/mol.
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