TL;DR: RefChem:297715 (CAS 141300-18-7) is a chemical compound with molecular formula C12H12N6O and molecular weight 256.10727 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-amino-6-(4-methylanilino)-1H-pyrazolo[5,4-d]pyrimidin-4-one
Also Known As: 4H-Pyrazolo(3,4-d)pyrimidin-4-one, 1,5-dihydro-5-amino-6-((4-methylphenyl)amino)-, 1,5-Dihydro-5-amino-6-((4-methylphenyl)amino)-4H-pyrazolo(3,4-d)pyrimidin-4-one, 5-amino-6-(4-methylanilino)-1H-pyrazolo[3,4-d]pyrimidin-4-one, 5-Amino-6-(4-methylanilino)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one, 5-amino-6-[(4-methylphenyl)amino]-1H,4H,5H-pyrazolo[3,4-d]pyrimidin-4-one
| Molecular Formula | C12H12N6O |
| Molecular Weight | 256.10727 g/mol |
| XLogP | 0.5 |
| Topological Polar Surface Area (TPSA) | 99.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 256.10727 Da |
| Heavy Atoms | 19 |
| Complexity | 390.0 |
| SMILES | CC1=CC=C(C=C1)NC2=NC3=C(C=NN3)C(=O)N2N |
| InChIKey | OKEPLQOMEFVNNF-UHFFFAOYSA-N |
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:297715. The TPSA of 99.4 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:297715. Following Lipinski's Rule of Five, RefChem:297715 has 3 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 RefChem:297715 is 141300-18-7.
The molecular formula of RefChem:297715 is C12H12N6O.
The molecular weight of RefChem:297715 is 256.10727 g/mol.
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