TL;DR: 3-[(2S)-3-methyl-1-(morpholin-4-yl)-1-oxobutan-2-yl]quinazolin-4(3H)-one (CAS 1173685-30-7) is a chemical compound with molecular formula C17H21N3O3 and molecular weight 315.1583 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[(2S)-3-methyl-1-morpholin-4-yl-1-oxobutan-2-yl]quinazolin-4-one
Also Known As: EiM07-17781, (S)-3-(3-methyl-1-morpholino-1-oxobutan-2-yl)quinazolin-4(3H)-one, 3-[(2S)-3-methyl-1-morpholin-4-yl-1-oxobutan-2-yl]quinazolin-4-one, 3-[(2S)-3-methyl-1-(morpholin-4-yl)-1-oxobutan-2-yl]quinazolin-4(3H)-one
| Molecular Formula | C17H21N3O3 |
| Molecular Weight | 315.1583 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 62.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 315.1583 Da |
| Heavy Atoms | 23 |
| Complexity | 485.0 |
| SMILES | CC(C)[C@@H](C(=O)N1CCOCC1)N2C=NC3=CC=CC=C3C2=O |
| InChIKey | BDQNQYQYWVTHQE-HNNXBMFYSA-N |
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[(2S)-3-methyl-1-(morpholin-4-yl)-1-oxobutan-2-yl]quinazolin-4(3H)-one. The TPSA of 62.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[(2S)-3-methyl-1-(morpholin-4-yl)-1-oxobutan-2-yl]quinazolin-4(3H)-one. Following Lipinski's Rule of Five, 3-[(2S)-3-methyl-1-(morpholin-4-yl)-1-oxobutan-2-yl]quinazolin-4(3H)-one 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 3-[(2S)-3-methyl-1-(morpholin-4-yl)-1-oxobutan-2-yl]quinazolin-4(3H)-one is 1173685-30-7.
The molecular formula of 3-[(2S)-3-methyl-1-(morpholin-4-yl)-1-oxobutan-2-yl]quinazolin-4(3H)-one is C17H21N3O3.
The molecular weight of 3-[(2S)-3-methyl-1-(morpholin-4-yl)-1-oxobutan-2-yl]quinazolin-4(3H)-one is 315.1583 g/mol.
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