TL;DR: 3-amino-6-(dimethylamino)-1-(4-methylphenyl)pyrazolo[3,4-d][1,3]oxazin-4(1H)-one (CAS 136860-18-9) is a chemical compound with molecular formula C14H15N5O2 and molecular weight 285.1226 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-amino-6-(dimethylamino)-1-(4-methylphenyl)pyrazolo[5,4-d][1,3]oxazin-4-one
Also Known As: 3-amino-6-(dimethylamino)-1-(4-methylphenyl)pyrazolo[3,4-d][1,3]oxazin-4(1H)-one, 3-amino-6-(dimethylamino)-1-(4-methylphenyl)-1H,4H-pyrazolo[3,4-d][1,3]oxazin-4-one, 3-amino-6-(dimethylamino)-1-(4-methylphenyl)pyrazolo[3,4-d][1,3]oxazin-4-one, 10F-932, 3-amino-6-(dimethylamino)-1-(p-tolyl)pyrazolo[3,4-d][1,3]oxazin-4-one
| Molecular Formula | C14H15N5O2 |
| Molecular Weight | 285.1226 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 85.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 285.1226 Da |
| Heavy Atoms | 21 |
| Complexity | 445.0 |
| SMILES | CC1=CC=C(C=C1)N2C3=C(C(=N2)N)C(=O)OC(=N3)N(C)C |
| InChIKey | JBDUQDUPYHRVJM-UHFFFAOYSA-N |
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-amino-6-(dimethylamino)-1-(4-methylphenyl)pyrazolo[3,4-d][1,3]oxazin-4(1H)-one. The TPSA of 85.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-amino-6-(dimethylamino)-1-(4-methylphenyl)pyrazolo[3,4-d][1,3]oxazin-4(1H)-one. Following Lipinski's Rule of Five, 3-amino-6-(dimethylamino)-1-(4-methylphenyl)pyrazolo[3,4-d][1,3]oxazin-4(1H)-one has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 3-amino-6-(dimethylamino)-1-(4-methylphenyl)pyrazolo[3,4-d][1,3]oxazin-4(1H)-one is 136860-18-9.
The molecular formula of 3-amino-6-(dimethylamino)-1-(4-methylphenyl)pyrazolo[3,4-d][1,3]oxazin-4(1H)-one is C14H15N5O2.
The molecular weight of 3-amino-6-(dimethylamino)-1-(4-methylphenyl)pyrazolo[3,4-d][1,3]oxazin-4(1H)-one is 285.1226 g/mol.
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