TL;DR: (2S)-N-benzyl-2-(1-methyl-2,4-dioxoquinazolin-3-yl)-3-phenylpropanamide (CAS 1173676-82-8) is a chemical compound with molecular formula C25H23N3O3 and molecular weight 413.17395 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-N-benzyl-2-(1-methyl-2,4-dioxoquinazolin-3-yl)-3-phenylpropanamide
Also Known As: (2S)-N-benzyl-2-(1-methyl-2,4-dioxoquinazolin-3-yl)-3-phenylpropanamide, (2S)-N-benzyl-2-(1-methyl-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)-3-phenylpropanamide, (S)-N-benzyl-2-(1-methyl-2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)-3-phenylpropanamide
| Molecular Formula | C25H23N3O3 |
| Molecular Weight | 413.17395 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 69.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 413.17395 Da |
| Heavy Atoms | 31 |
| Complexity | 654.0 |
| SMILES | CN1C2=CC=CC=C2C(=O)N(C1=O)[C@@H](CC3=CC=CC=C3)C(=O)NCC4=CC=CC=C4 |
| InChIKey | RQZRMOWRUXQNCO-QFIPXVFZSA-N |
The XLogP value of 3.6 indicates that (2S)-N-benzyl-2-(1-methyl-2,4-dioxoquinazolin-3-yl)-3-phenylpropanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.7 Ų falls within the moderate polarity range, balancing permeability and solubility for (2S)-N-benzyl-2-(1-methyl-2,4-dioxoquinazolin-3-yl)-3-phenylpropanamide. Following Lipinski's Rule of Five, (2S)-N-benzyl-2-(1-methyl-2,4-dioxoquinazolin-3-yl)-3-phenylpropanamide has 1 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-benzyl-2-(1-methyl-2,4-dioxoquinazolin-3-yl)-3-phenylpropanamide is 1173676-82-8.
The molecular formula of (2S)-N-benzyl-2-(1-methyl-2,4-dioxoquinazolin-3-yl)-3-phenylpropanamide is C25H23N3O3.
The molecular weight of (2S)-N-benzyl-2-(1-methyl-2,4-dioxoquinazolin-3-yl)-3-phenylpropanamide is 413.17395 g/mol.
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