TL;DR: (2S)-N-(2,4-dichlorophenyl)-2-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)propanamide (CAS 1173681-56-5) is a chemical compound with molecular formula C17H13Cl2N3O3 and molecular weight 377.0334 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-N-(2,4-dichlorophenyl)-2-(2,4-dioxo-1H-quinazolin-3-yl)propanamide
Also Known As: (S)-N-(2,4-dichlorophenyl)-2-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)propanamide, (2S)-N-(2,4-dichlorophenyl)-2-(2,4-dioxo-1H-quinazolin-3-yl)propanamide, (2S)-N-(2,4-dichlorophenyl)-2-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)propanamide
| Molecular Formula | C17H13Cl2N3O3 |
| Molecular Weight | 377.0334 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 78.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 377.0334 Da |
| Heavy Atoms | 25 |
| Complexity | 559.0 |
| SMILES | C[C@@H](C(=O)NC1=C(C=C(C=C1)Cl)Cl)N2C(=O)C3=CC=CC=C3NC2=O |
| InChIKey | USYLVVAENKFLBU-VIFPVBQESA-N |
The XLogP value of 3.2 indicates that (2S)-N-(2,4-dichlorophenyl)-2-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)propanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.5 Ų falls within the moderate polarity range, balancing permeability and solubility for (2S)-N-(2,4-dichlorophenyl)-2-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)propanamide. Following Lipinski's Rule of Five, (2S)-N-(2,4-dichlorophenyl)-2-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)propanamide has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (2S)-N-(2,4-dichlorophenyl)-2-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)propanamide is 1173681-56-5.
The molecular formula of (2S)-N-(2,4-dichlorophenyl)-2-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)propanamide is C17H13Cl2N3O3.
The molecular weight of (2S)-N-(2,4-dichlorophenyl)-2-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)propanamide is 377.0334 g/mol.
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