TL;DR: F2697-0039 (CAS 1002218-34-9) is a chemical compound with molecular formula C21H24N6O3 and molecular weight 408.19098 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(3-acetamidophenyl)-2-[2-(3,5-dimethylpyrazol-1-yl)-4,5-dimethyl-6-oxopyrimidin-1-yl]acetamide
Also Known As: F2697-0039, 2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)-4,5-dimethyl-6-oxo-1,6-dihydropyrimidin-1-yl]-N-(3-acetamidophenyl)acetamide, N-(3-acetamidophenyl)-2-[2-(3,5-dimethylpyrazol-1-yl)-4,5-dimethyl-6-oxopyrimidin-1-yl]acetamide, N-(3-acetamidophenyl)-2-(2-(3,5-dimethyl-1H-pyrazol-1-yl)-4,5-dimethyl-6-oxopyrimidin-1(6H)-yl)acetamide, N-m-acetylaminophenyl[2-(3,5-dimethyl-1-pyrazolyl)-4,5-dimethyl-6-oxo-1,6-dihydro-1-pyrimidinyl]acetamide
| Molecular Formula | C21H24N6O3 |
| Molecular Weight | 408.19098 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 109.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 408.19098 Da |
| Heavy Atoms | 30 |
| Complexity | 777.0 |
| SMILES | CC1=CC(=NN1C2=NC(=C(C(=O)N2CC(=O)NC3=CC=CC(=C3)NC(=O)C)C)C)C |
| InChIKey | WSELGYRXMPLIEN-UHFFFAOYSA-N |
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F2697-0039. The TPSA of 109.0 Ų falls within the moderate polarity range, balancing permeability and solubility for F2697-0039. Following Lipinski's Rule of Five, F2697-0039 has 2 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 F2697-0039 is 1002218-34-9.
The molecular formula of F2697-0039 is C21H24N6O3.
The molecular weight of F2697-0039 is 408.19098 g/mol.
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