TL;DR: 6H-Pyrazolo(3,4-c)isothiazol-3-amine, 4-methyl-6-phenyl- (CAS 107842-47-7) is a chemical compound with molecular formula C11H10N4S and molecular weight 230.06262 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-methyl-6-phenylpyrazolo[3,4-c][1,2]thiazol-3-amine
Also Known As: 6H-Pyrazolo(3,4-c)isothiazol-3-amine, 4-methyl-6-phenyl-, 4-methyl-6-phenylpyrazolo[3,4-c][1,2]thiazol-3-amine, 4-Methyl-6-phenyl-6H-pyrazolo(3,4-c)isothiazol-3-amine, 4-methyl-6-phenyl-pyrazolo[3,4-c]isothiazol-3-amine, 6H-Pyrazolo[3,4-c]isothiazol-3-amine, 4-methyl-6-phenyl-
| Molecular Formula | C11H10N4S |
| Molecular Weight | 230.06262 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 85.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 230.06262 Da |
| Heavy Atoms | 16 |
| Complexity | 256.0 |
| SMILES | CC1=NN(C2=NSC(=C12)N)C3=CC=CC=C3 |
| InChIKey | MGCQMHQYPUVXOL-UHFFFAOYSA-N |
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6H-Pyrazolo(3,4-c)isothiazol-3-amine, 4-methyl-6-phenyl-. The TPSA of 85.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 6H-Pyrazolo(3,4-c)isothiazol-3-amine, 4-methyl-6-phenyl-. Following Lipinski's Rule of Five, 6H-Pyrazolo(3,4-c)isothiazol-3-amine, 4-methyl-6-phenyl- 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 6H-Pyrazolo(3,4-c)isothiazol-3-amine, 4-methyl-6-phenyl- is 107842-47-7.
The molecular formula of 6H-Pyrazolo(3,4-c)isothiazol-3-amine, 4-methyl-6-phenyl- is C11H10N4S.
The molecular weight of 6H-Pyrazolo(3,4-c)isothiazol-3-amine, 4-methyl-6-phenyl- is 230.06262 g/mol.
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