TL;DR: (2S)-2-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)-N-(4-methoxyphenyl)propanamide (CAS 1173686-98-0) is a chemical compound with molecular formula C18H17N3O4 and molecular weight 339.12192 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-2-(2,4-dioxo-1H-quinazolin-3-yl)-N-(4-methoxyphenyl)propanamide
Also Known As: (2S)-2-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)-N-(4-methoxyphenyl)propanamide, (S)-2-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)-N-(4-methoxyphenyl)propanamide, (2S)-2-(2,4-dioxo-1H-quinazolin-3-yl)-N-(4-methoxyphenyl)propanamide
| Molecular Formula | C18H17N3O4 |
| Molecular Weight | 339.12192 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 87.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 339.12192 Da |
| Heavy Atoms | 25 |
| Complexity | 530.0 |
| SMILES | C[C@@H](C(=O)NC1=CC=C(C=C1)OC)N2C(=O)C3=CC=CC=C3NC2=O |
| InChIKey | CRWNVJITMAJAAC-NSHDSACASA-N |
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2S)-2-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)-N-(4-methoxyphenyl)propanamide. The TPSA of 87.7 Ų falls within the moderate polarity range, balancing permeability and solubility for (2S)-2-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)-N-(4-methoxyphenyl)propanamide. Following Lipinski's Rule of Five, (2S)-2-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)-N-(4-methoxyphenyl)propanamide has 2 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 (2S)-2-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)-N-(4-methoxyphenyl)propanamide is 1173686-98-0.
The molecular formula of (2S)-2-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)-N-(4-methoxyphenyl)propanamide is C18H17N3O4.
The molecular weight of (2S)-2-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)-N-(4-methoxyphenyl)propanamide is 339.12192 g/mol.
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